N-(6-aminopyrimidin-4-yl)acetamide;5-bromo-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one;tert-butyl N-(6-acetamidopyrimidin-4-yl)carbamate;tert-butyl N-(6-chloropyrimidin-4-yl)carbamate;6-chloropyrimidin-4-amine;N-[6-[[2-[(4-methoxyphenyl)methyl]-1-oxo-3H-isoindol-5-yl]amino]pyrimidin-4-yl]acetamide;bis(N-[6-[(1-oxo-2,3-dihydroisoindol-5-yl)amino]pyrimidin-4-yl]acetamide);oxolane;hydrochloride

C100H110BrCl3N30O16 — CID 157074141

IUPACN-(6-aminopyrimidin-4-yl)acetamide;5-bromo-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one;tert-butyl N-(6-acetamidopyrimidin-4-yl)carbamate;tert-butyl N-(6-chloropyrimidin-4-yl)carbamate;6-chloropyrimidin-4-amine;N-[6-[[2-[(4-methoxyphenyl)methyl]-1-oxo-3H-isoindol-5-yl]amino]pyrimidin-4-yl]acetamide;bis(N-[6-[(1-oxo-2,3-dihydroisoindol-5-yl)amino]pyrimidin-4-yl]acetamide);oxolane;hydrochloride
SMILESC1CCOC1.CC(=O)Nc1cc(N)ncn1.CC(=O)Nc1cc(NC(=O)OC(C)(C)C)ncn1.CC(=O)Nc1cc(Nc2ccc3c(c2)CNC3=O)ncn1.CC(=O)Nc1cc(Nc2ccc3c(c2)CNC3=O)ncn1.CC(C)(C)OC(=O)Nc1cc(Cl)ncn1.COc1ccc(CN2Cc3cc(Br)ccc3C2=O)cc1.COc1ccc(CN2Cc3cc(Nc4cc(NC(C)=O)ncn4)ccc3C2=O)cc1.Cl.Nc1cc(Cl)ncn1
InChIInChI=1S/C22H21N5O3.C16H14BrNO2.2C14H13N5O2.C11H16N4O3.C9H12ClN3O2.C6H8N4O.C4H4ClN3.C4H8O.ClH/c1-14(28)25-20-10-21(24-13-23-20)26-17-5-8-19-16(9-17)12-27(22(19)29)11-15-3-6-18(30-2)7-4-15;1-20-14-5-2-11(3-6-14)9-18-10-12-8-13(17)4-7-15(12)16(18)19;2*1-8(20)18-12-5-13(17-7-16-12)19-10-2-3-11-9(4-10)6-15-14(11)21;1-7(16)14-8-5-9(13-6-12-8)15-10(17)18-11(2,3)4;1-9(2,3)15-8(14)13-7-4-6(10)11-5-12-7;1-4(11)10-6-2-5(7)8-3-9-6;5-3-1-4(6)8-2-7-3;1-2-4-5-3-1;/h3-10,13H,11-12H2,1-2H3,(H2,23,24,25,26,28);2-8H,9-10H2,1H3;2*2-5,7H,6H2,1H3,(H,15,21)(H2,16,17,18,19,20);5-6H,1-4H3,(H2,12,13,14,15,16,17);4-5H,1-3H3,(H,11,12,13,14);2-3H,1H3,(H3,7,8,9,10,11);1-2H,(H2,6,7,8);1-4H2;1H
InChIKeyCBCLBMBBWAWLDE-UHFFFAOYSA-N
MW2174.44 g/mol
LogP16.01
Rot. Bonds19

About N-(6-aminopyrimidin-4-yl)acetamide;5-bromo-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one;tert-butyl N-(6-acetamidopyrimidin-4-yl)carbamate;tert-butyl N-(6-chloropyrimidin-4-yl)carbamate;6-chloropyrimidin-4-amine;N-[6-[[2-[(4-methoxyphenyl)methyl]-1-oxo-3H-isoindol-5-yl]amino]pyrimidin-4-yl]acetamide;bis(N-[6-[(1-oxo-2,3-dihydroisoindol-5-yl)amino]pyrimidin-4-yl]acetamide);oxolane;hydrochloride

N-(6-aminopyrimidin-4-yl)acetamide;5-bromo-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one;tert-butyl N-(6-acetamidopyrimidin-4-yl)carbamate;tert-butyl N-(6-chloropyrimidin-4-yl)carbamate;6-chloropyrimidin-4-amine;N-[6-[[2-[(4-methoxyphenyl)methyl]-1-oxo-3H-isoindol-5-yl]amino]pyrimidin-4-yl]acetamide;bis(N-[6-[(1-oxo-2,3-dihydroisoindol-5-yl)amino]pyrimidin-4-yl]acetamide);oxolane;hydrochloride (PubChem CID 157074141) has the molecular formula C100H110BrCl3N30O16 and a molecular weight of 2174.44 g/mol. Its IUPAC name is N-(6-aminopyrimidin-4-yl)acetamide;5-bromo-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one;tert-butyl N-(6-acetamidopyrimidin-4-yl)carbamate;tert-butyl N-(6-chloropyrimidin-4-yl)carbamate;6-chloropyrimidin-4-amine;N-[6-[[2-[(4-methoxyphenyl)methyl]-1-oxo-3H-isoindol-5-yl]amino]pyrimidin-4-yl]acetamide;bis(N-[6-[(1-oxo-2,3-dihydroisoindol-5-yl)amino]pyrimidin-4-yl]acetamide);oxolane;hydrochloride.

Molecular Properties

Compound NameN-(6-aminopyrimidin-4-yl)acetamide;5-bromo-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one;tert-butyl N-(6-acetamidopyrimidin-4-yl)carbamate;tert-butyl N-(6-chloropyrimidin-4-yl)carbamate;6-chloropyrimidin-4-amine;N-[6-[[2-[(4-methoxyphenyl)methyl]-1-oxo-3H-isoindol-5-yl]amino]pyrimidin-4-yl]acetamide;bis(N-[6-[(1-oxo-2,3-dihydroisoindol-5-yl)amino]pyrimidin-4-yl]acetamide);oxolane;hydrochloride
PubChem CID157074141
Molecular FormulaC100H110BrCl3N30O16
Molecular Weight2174.44 g/mol
Exact Mass2170.70
IUPAC NameN-(6-aminopyrimidin-4-yl)acetamide;5-bromo-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one;tert-butyl N-(6-acetamidopyrimidin-4-yl)carbamate;tert-butyl N-(6-chloropyrimidin-4-yl)carbamate;6-chloropyrimidin-4-amine;N-[6-[[2-[(4-methoxyphenyl)methyl]-1-oxo-3H-isoindol-5-yl]amino]pyrimidin-4-yl]acetamide;bis(N-[6-[(1-oxo-2,3-dihydroisoindol-5-yl)amino]pyrimidin-4-yl]acetamide);oxolane;hydrochloride
SMILESC1CCOC1.CC(=O)Nc1cc(N)ncn1.CC(=O)Nc1cc(NC(=O)OC(C)(C)C)ncn1.CC(=O)Nc1cc(Nc2ccc3c(c2)CNC3=O)ncn1.CC(=O)Nc1cc(Nc2ccc3c(c2)CNC3=O)ncn1.CC(C)(C)OC(=O)Nc1cc(Cl)ncn1.COc1ccc(CN2Cc3cc(Br)ccc3C2=O)cc1.COc1ccc(CN2Cc3cc(Nc4cc(NC(C)=O)ncn4)ccc3C2=O)cc1.Cl.Nc1cc(Cl)ncn1
InChIInChI=1S/C22H21N5O3.C16H14BrNO2.2C14H13N5O2.C11H16N4O3.C9H12ClN3O2.C6H8N4O.C4H4ClN3.C4H8O.ClH/c1-14(28)25-20-10-21(24-13-23-20)26-17-5-8-19-16(9-17)12-27(22(19)29)11-15-3-6-18(30-2)7-4-15;1-20-14-5-2-11(3-6-14)9-18-10-12-8-13(17)4-7-15(12)16(18)19;2*1-8(20)18-12-5-13(17-7-16-12)19-10-2-3-11-9(4-10)6-15-14(11)21;1-7(16)14-8-5-9(13-6-12-8)15-10(17)18-11(2,3)4;1-9(2,3)15-8(14)13-7-4-6(10)11-5-12-7;1-4(11)10-6-2-5(7)8-3-9-6;5-3-1-4(6)8-2-7-3;1-2-4-5-3-1;/h3-10,13H,11-12H2,1-2H3,(H2,23,24,25,26,28);2-8H,9-10H2,1H3;2*2-5,7H,6H2,1H3,(H,15,21)(H2,16,17,18,19,20);5-6H,1-4H3,(H2,12,13,14,15,16,17);4-5H,1-3H3,(H,11,12,13,14);2-3H,1H3,(H3,7,8,9,10,11);1-2H,(H2,6,7,8);1-4H2;1H
InChIKeyCBCLBMBBWAWLDE-UHFFFAOYSA-N
XLogP16.01
TPSA617.26 Ų
H-Bond Donors14
H-Bond Acceptors35
Rotatable Bonds19
Heavy Atoms150
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002174.44
LogP ≤ 516.01
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1035

Analyze N-(6-aminopyrimidin-4-yl)acetamide;5-bromo-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one;tert-butyl N-(6-acetamidopyrimidin-4-yl)carbamate;tert-butyl N-(6-chloropyrimidin-4-yl)carbamate;6-chloropyrimidin-4-amine;N-[6-[[2-[(4-methoxyphenyl)methyl]-1-oxo-3H-isoindol-5-yl]amino]pyrimidin-4-yl]acetamide;bis(N-[6-[(1-oxo-2,3-dihydroisoindol-5-yl)amino]pyrimidin-4-yl]acetamide);oxolane;hydrochloride with MolForge

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Related Compounds

sodium;5'-[(6-amino-5-methylpyrimidin-4-yl)amino]-2'-[(4-methoxyphenyl)methyl]-7'-(trifluoromethyl)spiro[cyclohexane-1,3'-isoindole]-1'-one;5-[(6-amino-5-methylpyrimidin-4-yl)amino]-7-(trifluoromethyl)spiro[2H-isoindole-3,1'-cyclohexane]-1-one;N-(6-amino-5-methylpyrimidin-4-yl)cyclopropanecarboxamide;5-bromo-2-[(4-methoxyphenyl)methyl]-7-(trifluoromethyl)-3H-isoindol-1-one;5'-bromo-2'-[(4-methoxyphenyl)methyl]-7'-(trifluoromethyl)spiro[cyclohexane-1,3'-isoindole]-1'-one;methane;N-[6-[[2'-[(4-methoxyphenyl)methyl]-1'-oxo-7'-(trifluoromethyl)spiro[cyclohexane-1,3'-isoindole]-5'-yl]amino]-5-methylpyrimidin-4-yl]cyclopropanecarboxamide;hydroxide
CID 160011970
5'-bromo-7'-chloro-2'-[(4-methoxyphenyl)methyl]spiro[cyclohexane-1,3'-isoindole]-1'-one;7'-chloro-2'-[(4-methoxyphenyl)methyl]-5'-(pyrimidin-4-ylamino)spiro[cyclohexane-1,3'-isoindole]-1'-one;bis(7-chloro-5-(pyrimidin-4-ylamino)spiro[2H-isoindole-3,1'-cyclohexane]-1-one);pyrimidin-4-amine
CID 157171723
bis(5-(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)-2,3-dihydroisoindol-1-one);5-bromo-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one;4-chloro-7H-cyclopenta[d]pyrimidine;(4-methoxyphenyl)methanamine;N-[(4-methoxyphenyl)methyl]-7H-cyclopenta[d]pyrimidin-4-amine;2-[(4-methoxyphenyl)methyl]-5-[4-[(4-methoxyphenyl)methylamino]pyrrolo[2,3-d]pyrimidin-7-yl]-3H-isoindol-1-one
CID 157180306
4-aminopyrimidine-5-carbonitrile;5-bromo-2-[(4-methoxyphenyl)methyl]-1',7-dimethylspiro[isoindole-3,4'-piperidine]-1-one;bis(4-[(1',7-dimethyl-1-oxospiro[2H-isoindole-3,4'-piperidine]-5-yl)amino]pyrimidine-5-carbonitrile);4-[[2-[(4-methoxyphenyl)methyl]-1',7-dimethyl-1-oxospiro[isoindole-3,4'-piperidine]-5-yl]amino]pyrimidine-5-carbonitrile
CID 157193390
5-amino-2-[(2,4-dimethoxyphenyl)methyl]-3-methyl-3H-isoindol-1-one;5-bromo-2-[(2,4-dimethoxyphenyl)methyl]-3-methyl-3H-isoindol-1-one;tert-butyl carbamate;tert-butyl N-[2-[(2,4-dimethoxyphenyl)methyl]-3-methyl-1-oxo-3H-isoindol-5-yl]carbamate;4-chloro-6-methylpyrimidine;2-[(2,4-dimethoxyphenyl)methyl]-3-methyl-5-[(6-methylpyrimidin-4-yl)amino]-3H-isoindol-1-one;methane;methanol;3-methyl-5-[(6-methylpyrimidin-4-yl)amino]-2,3-dihydroisoindol-1-one
CID 157283797
5-[(6-amino-5-methylpyrimidin-4-yl)amino]-7-fluorospiro[2H-isoindole-3,1'-cyclohexane]-1-one;5-bromo-7-fluoro-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one;5'-bromo-7'-fluoro-2'-[(4-methoxyphenyl)methyl]spiro[cyclohexane-1,3'-isoindole]-1'-one;4-bromo-2-fluoro-6-methylbenzoic acid;tert-butyl N-[7'-fluoro-2'-[(4-methoxyphenyl)methyl]-1'-oxospiro[cyclohexane-1,3'-isoindole]-5'-yl]carbamate;deuterio(fluoro)methane;(4-methoxyphenyl)methanamine;methyl 4-bromo-2-(bromomethyl)-6-fluorobenzoate;methyl 4-bromo-2-fluoro-6-methylbenzoate
CID 157323391
5-bromo-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one;2-[(4-methoxyphenyl)methyl]-5-(4-methylpyrrolo[2,3-d]pyrimidin-7-yl)-3H-isoindol-1-one;4-methyl-7H-pyrrolo[2,3-d]pyrimidine;5-(4-methylpyrrolo[2,3-d]pyrimidin-7-yl)-2,3-dihydroisoindol-1-one
CID 157343135
5'-(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)-7'-chloro-2'-[(4-methoxyphenyl)methyl]spiro[cyclohexane-1,3'-isoindole]-1'-one;bis(5-(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)-7-chlorospiro[2H-isoindole-3,1'-cyclohexane]-1-one);5-bromo-7-chloro-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one;5'-bromo-7'-chloro-2'-[(4-methoxyphenyl)methyl]spiro[cyclohexane-1,3'-isoindole]-1'-one;7H-cyclopenta[d]pyrimidin-4-amine;1,5-diiodopentane
CID 157379808
5-bromo-7-chloro-2-[(4-methoxyphenyl)methyl]-3,3-dimethylisoindol-1-one;5-bromo-7-chloro-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one;bis(7-chloro-3,3-dimethyl-5-(pyrimidin-4-ylamino)-2H-isoindol-1-one);7-chloro-2-[(4-methoxyphenyl)methyl]-3,3-dimethyl-5-(pyrimidin-4-ylamino)isoindol-1-one;pyrimidin-4-amine
CID 157486419
potassium;bis(5-[(6-aminopyrimidin-4-yl)amino]-7-chlorospiro[2H-isoindole-3,1'-cyclohexane]-1-one);N-(6-aminopyrimidin-4-yl)cyclopropanecarboxamide;5'-bromo-7'-chloro-2'-[(4-methoxyphenyl)methyl]spiro[cyclohexane-1,3'-isoindole]-1'-one;N-[6-[[7'-chloro-2'-[(4-methoxyphenyl)methyl]-1'-oxospiro[cyclohexane-1,3'-isoindole]-5'-yl]amino]pyrimidin-4-yl]cyclopropanecarboxamide;N-[6-[(7-chloro-1-oxospiro[2H-isoindole-3,1'-cyclohexane]-5-yl)amino]pyrimidin-4-yl]cyclopropanecarboxamide;hydroxide
CID 157526028
5-bromo-7-fluoro-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one;7H-cyclopenta[d]pyrimidine;7-fluoro-2-[(4-methoxyphenyl)methyl]-5-pyrrolo[2,3-d]pyrimidin-7-yl-3H-isoindol-1-one;7-fluoro-5-pyrrolo[2,3-d]pyrimidin-7-yl-2,3-dihydroisoindol-1-one;(4-methoxyphenyl)methanamine;methyl 4-bromo-2-(bromomethyl)-6-fluorobenzoate;methyl 4-bromo-2-fluoro-6-methylbenzoate
CID 157535347
potassium;5-[(6-amino-5-methoxypyrimidin-4-yl)amino]-1'-(2,2-difluoroethyl)-2-[(4-methoxyphenyl)methyl]-7-methylspiro[isoindole-3,4'-piperidine]-1-one;bis(5-[(6-amino-5-methoxypyrimidin-4-yl)amino]-1'-(2,2-difluoroethyl)-7-methylspiro[2H-isoindole-3,4'-piperidine]-1-one);N-(6-amino-5-methoxypyrimidin-4-yl)cyclopropanecarboxamide;5-bromo-1'-(2,2-difluoroethyl)-2-[(4-methoxyphenyl)methyl]-7-methylspiro[isoindole-3,4'-piperidine]-1-one;N-[6-[[1'-(2,2-difluoroethyl)-2-[(4-methoxyphenyl)methyl]-7-methyl-1-oxospiro[isoindole-3,4'-piperidine]-5-yl]amino]-5-methoxypyrimidin-4-yl]cyclopropanecarboxamide;methane;hydroxide
CID 157665043

Frequently Asked Questions

What is the IUPAC name of N-(6-aminopyrimidin-4-yl)acetamide;5-bromo-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one;tert-butyl N-(6-acetamidopyrimidin-4-yl)carbamate;tert-butyl N-(6-chloropyrimidin-4-yl)carbamate;6-chloropyrimidin-4-amine;N-[6-[[2-[(4-methoxyphenyl)methyl]-1-oxo-3H-isoindol-5-yl]amino]pyrimidin-4-yl]acetamide;bis(N-[6-[(1-oxo-2,3-dihydroisoindol-5-yl)amino]pyrimidin-4-yl]acetamide);oxolane;hydrochloride?
The IUPAC name of N-(6-aminopyrimidin-4-yl)acetamide;5-bromo-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one;tert-butyl N-(6-acetamidopyrimidin-4-yl)carbamate;tert-butyl N-(6-chloropyrimidin-4-yl)carbamate;6-chloropyrimidin-4-amine;N-[6-[[2-[(4-methoxyphenyl)methyl]-1-oxo-3H-isoindol-5-yl]amino]pyrimidin-4-yl]acetamide;bis(N-[6-[(1-oxo-2,3-dihydroisoindol-5-yl)amino]pyrimidin-4-yl]acetamide);oxolane;hydrochloride (CID 157074141) is N-(6-aminopyrimidin-4-yl)acetamide;5-bromo-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one;tert-butyl N-(6-acetamidopyrimidin-4-yl)carbamate;tert-butyl N-(6-chloropyrimidin-4-yl)carbamate;6-chloropyrimidin-4-amine;N-[6-[[2-[(4-methoxyphenyl)methyl]-1-oxo-3H-isoindol-5-yl]amino]pyrimidin-4-yl]acetamide;bis(N-[6-[(1-oxo-2,3-dihydroisoindol-5-yl)amino]pyrimidin-4-yl]acetamide);oxolane;hydrochloride.
What is the SMILES notation for N-(6-aminopyrimidin-4-yl)acetamide;5-bromo-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one;tert-butyl N-(6-acetamidopyrimidin-4-yl)carbamate;tert-butyl N-(6-chloropyrimidin-4-yl)carbamate;6-chloropyrimidin-4-amine;N-[6-[[2-[(4-methoxyphenyl)methyl]-1-oxo-3H-isoindol-5-yl]amino]pyrimidin-4-yl]acetamide;bis(N-[6-[(1-oxo-2,3-dihydroisoindol-5-yl)amino]pyrimidin-4-yl]acetamide);oxolane;hydrochloride?
The canonical SMILES for N-(6-aminopyrimidin-4-yl)acetamide;5-bromo-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one;tert-butyl N-(6-acetamidopyrimidin-4-yl)carbamate;tert-butyl N-(6-chloropyrimidin-4-yl)carbamate;6-chloropyrimidin-4-amine;N-[6-[[2-[(4-methoxyphenyl)methyl]-1-oxo-3H-isoindol-5-yl]amino]pyrimidin-4-yl]acetamide;bis(N-[6-[(1-oxo-2,3-dihydroisoindol-5-yl)amino]pyrimidin-4-yl]acetamide);oxolane;hydrochloride is C1CCOC1.CC(=O)Nc1cc(N)ncn1.CC(=O)Nc1cc(NC(=O)OC(C)(C)C)ncn1.CC(=O)Nc1cc(Nc2ccc3c(c2)CNC3=O)ncn1.CC(=O)Nc1cc(Nc2ccc3c(c2)CNC3=O)ncn1.CC(C)(C)OC(=O)Nc1cc(Cl)ncn1.COc1ccc(CN2Cc3cc(Br)ccc3C2=O)cc1.COc1ccc(CN2Cc3cc(Nc4cc(NC(C)=O)ncn4)ccc3C2=O)cc1.Cl.Nc1cc(Cl)ncn1.
What is the InChIKey of N-(6-aminopyrimidin-4-yl)acetamide;5-bromo-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one;tert-butyl N-(6-acetamidopyrimidin-4-yl)carbamate;tert-butyl N-(6-chloropyrimidin-4-yl)carbamate;6-chloropyrimidin-4-amine;N-[6-[[2-[(4-methoxyphenyl)methyl]-1-oxo-3H-isoindol-5-yl]amino]pyrimidin-4-yl]acetamide;bis(N-[6-[(1-oxo-2,3-dihydroisoindol-5-yl)amino]pyrimidin-4-yl]acetamide);oxolane;hydrochloride?
The InChIKey is CBCLBMBBWAWLDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N5O3.C16H14BrNO2.2C14H13N5O2.C11H16N4O3.C9H12ClN3O2.C6H8N4O.C4H4ClN3.C4H8O.ClH/c1-14(28)25-20-10-21(24-13-23-20)26-17-5-8-19-16(9-17)12-27(22(19)29)11-15-3-6-18(30-2)7-4-15;1-20-14-5-2-11(3-6-14)9-18-10-12-8-13(17)4-7-15(12)16(18)19;2*1-8(20)18-12-5-13(17-7-16-12)19-10-2-3-11-9(4-10)6-15-14(11)21;1-7(16)14-8-5-9(13-6-12-8)15-10(17)18-11(2,3)4;1-9(2,3)15-8(14)13-7-4-6(10)11-5-12-7;1-4(11)10-6-2-5(7)8-3-9-6;5-3-1-4(6)8-2-7-3;1-2-4-5-3-1;/h3-10,13H,11-12H2,1-2H3,(H2,23,24,25,26,28);2-8H,9-10H2,1H3;2*2-5,7H,6H2,1H3,(H,15,21)(H2,16,17,18,19,20);5-6H,1-4H3,(H2,12,13,14,15,16,17);4-5H,1-3H3,(H,11,12,13,14);2-3H,1H3,(H3,7,8,9,10,11);1-2H,(H2,6,7,8);1-4H2;1H.
What are the key properties of N-(6-aminopyrimidin-4-yl)acetamide;5-bromo-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one;tert-butyl N-(6-acetamidopyrimidin-4-yl)carbamate;tert-butyl N-(6-chloropyrimidin-4-yl)carbamate;6-chloropyrimidin-4-amine;N-[6-[[2-[(4-methoxyphenyl)methyl]-1-oxo-3H-isoindol-5-yl]amino]pyrimidin-4-yl]acetamide;bis(N-[6-[(1-oxo-2,3-dihydroisoindol-5-yl)amino]pyrimidin-4-yl]acetamide);oxolane;hydrochloride?
N-(6-aminopyrimidin-4-yl)acetamide;5-bromo-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one;tert-butyl N-(6-acetamidopyrimidin-4-yl)carbamate;tert-butyl N-(6-chloropyrimidin-4-yl)carbamate;6-chloropyrimidin-4-amine;N-[6-[[2-[(4-methoxyphenyl)methyl]-1-oxo-3H-isoindol-5-yl]amino]pyrimidin-4-yl]acetamide;bis(N-[6-[(1-oxo-2,3-dihydroisoindol-5-yl)amino]pyrimidin-4-yl]acetamide);oxolane;hydrochloride has a molecular weight of 2174.44 g/mol, XLogP of 16.01, 19 rotatable bonds, 14 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-aminopyrimidin-4-yl)acetamide;5-bromo-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one;tert-butyl N-(6-acetamidopyrimidin-4-yl)carbamate;tert-butyl N-(6-chloropyrimidin-4-yl)carbamate;6-chloropyrimidin-4-amine;N-[6-[[2-[(4-methoxyphenyl)methyl]-1-oxo-3H-isoindol-5-yl]amino]pyrimidin-4-yl]acetamide;bis(N-[6-[(1-oxo-2,3-dihydroisoindol-5-yl)amino]pyrimidin-4-yl]acetamide);oxolane;hydrochloride is sourced from PubChem (CID 157074141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).