2-chloro-8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;2-chloro-N-(furan-2-ylmethyl)-7-(2-methoxyethyl)pyrrolo[2,3-d]pyrimidin-4-amine;2-chloro-N-(furan-2-ylmethyl)-8-phenyl-7H-purin-6-amine;8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;N-(furan-2-ylmethyl)-5-pyridin-4-yl-7H-pyrrolo[2,3-d]pyrimidin-4-amine

C72H65Cl3N24O6 — CID 160579145

IUPAC2-chloro-8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;2-chloro-N-(furan-2-ylmethyl)-7-(2-methoxyethyl)pyrrolo[2,3-d]pyrimidin-4-amine;2-chloro-N-(furan-2-ylmethyl)-8-phenyl-7H-purin-6-amine;8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;N-(furan-2-ylmethyl)-5-pyridin-4-yl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
SMILESCOCCn1ccc2c(NCc3ccco3)nc(Cl)nc21.Clc1nc(NCc2ccco2)c2[nH]c(-c3ccccc3)nc2n1.Clc1nc(NCc2ccco2)c2[nH]c(C3CC3)nc2n1.c1coc(CNc2ncnc3[nH]cc(-c4ccncc4)c23)c1.c1coc(CNc2ncnc3nc(C4CC4)[nH]c23)c1
InChIInChI=1S/C16H12ClN5O.C16H13N5O.C14H15ClN4O2.C13H12ClN5O.C13H13N5O/c17-16-21-14(18-9-11-7-4-8-23-11)12-15(22-16)20-13(19-12)10-5-2-1-3-6-10;1-2-12(22-7-1)8-18-15-14-13(11-3-5-17-6-4-11)9-19-16(14)21-10-20-15;1-20-8-6-19-5-4-11-12(17-14(15)18-13(11)19)16-9-10-3-2-7-21-10;14-13-18-11(15-6-8-2-1-5-20-8)9-12(19-13)17-10(16-9)7-3-4-7;1-2-9(19-5-1)6-14-12-10-13(16-7-15-12)18-11(17-10)8-3-4-8/h1-8H,9H2,(H2,18,19,20,21,22);1-7,9-10H,8H2,(H2,18,19,20,21);2-5,7H,6,8-9H2,1H3,(H,16,17,18);1-2,5,7H,3-4,6H2,(H2,15,16,17,18,19);1-2,5,7-8H,3-4,6H2,(H2,14,15,16,17,18)
InChIKeyRBNSFOWGEWKXCM-UHFFFAOYSA-N
MW1468.83 g/mol
LogP15.56
Rot. Bonds22

About 2-chloro-8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;2-chloro-N-(furan-2-ylmethyl)-7-(2-methoxyethyl)pyrrolo[2,3-d]pyrimidin-4-amine;2-chloro-N-(furan-2-ylmethyl)-8-phenyl-7H-purin-6-amine;8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;N-(furan-2-ylmethyl)-5-pyridin-4-yl-7H-pyrrolo[2,3-d]pyrimidin-4-amine

2-chloro-8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;2-chloro-N-(furan-2-ylmethyl)-7-(2-methoxyethyl)pyrrolo[2,3-d]pyrimidin-4-amine;2-chloro-N-(furan-2-ylmethyl)-8-phenyl-7H-purin-6-amine;8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;N-(furan-2-ylmethyl)-5-pyridin-4-yl-7H-pyrrolo[2,3-d]pyrimidin-4-amine (PubChem CID 160579145) has the molecular formula C72H65Cl3N24O6 and a molecular weight of 1468.83 g/mol. Its IUPAC name is 2-chloro-8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;2-chloro-N-(furan-2-ylmethyl)-7-(2-methoxyethyl)pyrrolo[2,3-d]pyrimidin-4-amine;2-chloro-N-(furan-2-ylmethyl)-8-phenyl-7H-purin-6-amine;8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;N-(furan-2-ylmethyl)-5-pyridin-4-yl-7H-pyrrolo[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-chloro-8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;2-chloro-N-(furan-2-ylmethyl)-7-(2-methoxyethyl)pyrrolo[2,3-d]pyrimidin-4-amine;2-chloro-N-(furan-2-ylmethyl)-8-phenyl-7H-purin-6-amine;8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;N-(furan-2-ylmethyl)-5-pyridin-4-yl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
PubChem CID160579145
Molecular FormulaC72H65Cl3N24O6
Molecular Weight1468.83 g/mol
Exact Mass1466.46
IUPAC Name2-chloro-8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;2-chloro-N-(furan-2-ylmethyl)-7-(2-methoxyethyl)pyrrolo[2,3-d]pyrimidin-4-amine;2-chloro-N-(furan-2-ylmethyl)-8-phenyl-7H-purin-6-amine;8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;N-(furan-2-ylmethyl)-5-pyridin-4-yl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
SMILESCOCCn1ccc2c(NCc3ccco3)nc(Cl)nc21.Clc1nc(NCc2ccco2)c2[nH]c(-c3ccccc3)nc2n1.Clc1nc(NCc2ccco2)c2[nH]c(C3CC3)nc2n1.c1coc(CNc2ncnc3[nH]cc(-c4ccncc4)c23)c1.c1coc(CNc2ncnc3nc(C4CC4)[nH]c23)c1
InChIInChI=1S/C16H12ClN5O.C16H13N5O.C14H15ClN4O2.C13H12ClN5O.C13H13N5O/c17-16-21-14(18-9-11-7-4-8-23-11)12-15(22-16)20-13(19-12)10-5-2-1-3-6-10;1-2-12(22-7-1)8-18-15-14-13(11-3-5-17-6-4-11)9-19-16(14)21-10-20-15;1-20-8-6-19-5-4-11-12(17-14(15)18-13(11)19)16-9-10-3-2-7-21-10;14-13-18-11(15-6-8-2-1-5-20-8)9-12(19-13)17-10(16-9)7-3-4-7;1-2-9(19-5-1)6-14-12-10-13(16-7-15-12)18-11(17-10)8-3-4-8/h1-8H,9H2,(H2,18,19,20,21,22);1-7,9-10H,8H2,(H2,18,19,20,21);2-5,7H,6,8-9H2,1H3,(H,16,17,18);1-2,5,7H,3-4,6H2,(H2,15,16,17,18,19);1-2,5,7-8H,3-4,6H2,(H2,14,15,16,17,18)
InChIKeyRBNSFOWGEWKXCM-UHFFFAOYSA-N
XLogP15.56
TPSA383.63 Ų
H-Bond Donors9
H-Bond Acceptors26
Rotatable Bonds22
Heavy Atoms105
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001468.83
LogP ≤ 515.56
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1026

Analyze 2-chloro-8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;2-chloro-N-(furan-2-ylmethyl)-7-(2-methoxyethyl)pyrrolo[2,3-d]pyrimidin-4-amine;2-chloro-N-(furan-2-ylmethyl)-8-phenyl-7H-purin-6-amine;8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;N-(furan-2-ylmethyl)-5-pyridin-4-yl-7H-pyrrolo[2,3-d]pyrimidin-4-amine with MolForge

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Related Compounds

2-chloro-5-fluoro-N-(furan-2-ylmethyl)-6-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine;2-[2-chloro-4-(furan-2-ylmethylamino)pyrrolo[2,3-d]pyrimidin-7-yl]-N-methylacetamide;2-chloro-N-(furan-2-ylmethyl)-5-(methoxymethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine;2-chloro-N-(furan-2-ylmethyl)-7-(3,3,3-trifluoropropyl)pyrrolo[2,3-d]pyrimidin-4-amine
CID 158085074
ethyl 4-[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]piperidine-1-carboxylate;4-[5-(4-fluorophenyl)-3-(furan-2-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;4-[5-(4-fluorophenyl)-3-(furan-3-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;4-[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]-N,N-dimethylcyclohexan-1-amine;4-[5-(4-fluorophenyl)-3-[3-(trifluoromethoxy)propyl]imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine
CID 158403835
2-chloro-6-N-(furan-2-ylmethyl)-8-N,8-N-dimethyl-7H-purine-6,8-diamine;2-chloro-N-(furan-2-ylmethyl)-7-methylpurin-6-amine;2-chloro-N-(furan-2-ylmethyl)-9-methylpurin-6-amine;2-chloro-N-(furan-2-ylmethyl)-8-propan-2-yloxy-7H-purin-6-amine;2-chloro-N-(furan-2-ylmethyl)-8-(2,2,2-trifluoroethoxy)-7H-purin-6-amine
CID 159230109
N-(furan-2-ylmethyl)-5H-cyclopenta[d]pyrimidin-4-amine;N-(furan-2-ylmethyl)-9-methylpurin-6-amine;6-N-(furan-2-ylmethyl)-2-N-methyl-7H-purine-2,6-diamine;N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-7H-purin-6-amine;N-[2-(trifluoromethyl)phenyl]-7H-purin-6-amine
CID 159984627
2-bromo-N-(furan-2-ylmethyl)-7H-purin-6-amine;2-chloro-N-(furan-2-ylmethyl)-8-(oxetan-3-yloxy)-7H-purin-6-amine;2-chloro-N-(furan-2-ylmethyl)-8-(2,2,2-trifluoroethoxy)-7H-purin-6-amine;2-chloro-N-[(3-methyl-4-pyridinyl)methyl]-7H-purin-6-amine;2-chloro-8-N-(oxetan-3-yl)-6-N-(pyrimidin-4-ylmethyl)-7H-purine-6,8-diamine
CID 161165918
N-(furan-2-ylmethyl)-2-phenyl-7H-purin-6-amine;3-[(7H-purin-6-ylamino)methyl]benzoic acid;N-(2-pyridin-3-ylethyl)-7H-purin-6-amine;N-[[4-(trifluoromethyl)phenyl]methyl]-7H-purin-6-amine
CID 162055386
N-(furan-2-ylmethyl)-4-[5-(5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptan-2-yl)imidazo[1,2-c]pyrimidin-7-yl]pyridin-2-amine
CID 11270341
3-(furan-2-ylmethyl)-N-[1-[2-(3H-imidazo[4,5-c]pyridin-2-ylamino)ethyl]piperidin-4-yl]imidazo[4,5-b]pyridin-2-amine
CID 13983198
N-[2-[4-[[1-(furan-2-ylmethyl)benzimidazol-2-yl]methyl]piperidin-1-yl]ethyl]-3H-imidazo[4,5-c]pyridin-2-amine
CID 14013248
N-[2-[4-[[3-(furan-2-ylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]piperidin-1-yl]ethyl]-3H-imidazo[4,5-c]pyridin-2-amine
CID 14013508
N-benzyl-7H-purin-2-amine;N-(furan-2-ylmethyl)-7H-purin-6-amine
CID 67798334
(3R,4R)-N-(furan-2-ylmethyl)-4-methyl-3-(3,8,10-triazatricyclo[7.3.0.02,6]dodeca-1,4,6,8,11-pentaen-3-yl)piperidine-1-carboxamide
CID 68034619

Frequently Asked Questions

What is the IUPAC name of 2-chloro-8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;2-chloro-N-(furan-2-ylmethyl)-7-(2-methoxyethyl)pyrrolo[2,3-d]pyrimidin-4-amine;2-chloro-N-(furan-2-ylmethyl)-8-phenyl-7H-purin-6-amine;8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;N-(furan-2-ylmethyl)-5-pyridin-4-yl-7H-pyrrolo[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-chloro-8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;2-chloro-N-(furan-2-ylmethyl)-7-(2-methoxyethyl)pyrrolo[2,3-d]pyrimidin-4-amine;2-chloro-N-(furan-2-ylmethyl)-8-phenyl-7H-purin-6-amine;8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;N-(furan-2-ylmethyl)-5-pyridin-4-yl-7H-pyrrolo[2,3-d]pyrimidin-4-amine (CID 160579145) is 2-chloro-8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;2-chloro-N-(furan-2-ylmethyl)-7-(2-methoxyethyl)pyrrolo[2,3-d]pyrimidin-4-amine;2-chloro-N-(furan-2-ylmethyl)-8-phenyl-7H-purin-6-amine;8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;N-(furan-2-ylmethyl)-5-pyridin-4-yl-7H-pyrrolo[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-chloro-8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;2-chloro-N-(furan-2-ylmethyl)-7-(2-methoxyethyl)pyrrolo[2,3-d]pyrimidin-4-amine;2-chloro-N-(furan-2-ylmethyl)-8-phenyl-7H-purin-6-amine;8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;N-(furan-2-ylmethyl)-5-pyridin-4-yl-7H-pyrrolo[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-chloro-8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;2-chloro-N-(furan-2-ylmethyl)-7-(2-methoxyethyl)pyrrolo[2,3-d]pyrimidin-4-amine;2-chloro-N-(furan-2-ylmethyl)-8-phenyl-7H-purin-6-amine;8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;N-(furan-2-ylmethyl)-5-pyridin-4-yl-7H-pyrrolo[2,3-d]pyrimidin-4-amine is COCCn1ccc2c(NCc3ccco3)nc(Cl)nc21.Clc1nc(NCc2ccco2)c2[nH]c(-c3ccccc3)nc2n1.Clc1nc(NCc2ccco2)c2[nH]c(C3CC3)nc2n1.c1coc(CNc2ncnc3[nH]cc(-c4ccncc4)c23)c1.c1coc(CNc2ncnc3nc(C4CC4)[nH]c23)c1.
What is the InChIKey of 2-chloro-8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;2-chloro-N-(furan-2-ylmethyl)-7-(2-methoxyethyl)pyrrolo[2,3-d]pyrimidin-4-amine;2-chloro-N-(furan-2-ylmethyl)-8-phenyl-7H-purin-6-amine;8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;N-(furan-2-ylmethyl)-5-pyridin-4-yl-7H-pyrrolo[2,3-d]pyrimidin-4-amine?
The InChIKey is RBNSFOWGEWKXCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12ClN5O.C16H13N5O.C14H15ClN4O2.C13H12ClN5O.C13H13N5O/c17-16-21-14(18-9-11-7-4-8-23-11)12-15(22-16)20-13(19-12)10-5-2-1-3-6-10;1-2-12(22-7-1)8-18-15-14-13(11-3-5-17-6-4-11)9-19-16(14)21-10-20-15;1-20-8-6-19-5-4-11-12(17-14(15)18-13(11)19)16-9-10-3-2-7-21-10;14-13-18-11(15-6-8-2-1-5-20-8)9-12(19-13)17-10(16-9)7-3-4-7;1-2-9(19-5-1)6-14-12-10-13(16-7-15-12)18-11(17-10)8-3-4-8/h1-8H,9H2,(H2,18,19,20,21,22);1-7,9-10H,8H2,(H2,18,19,20,21);2-5,7H,6,8-9H2,1H3,(H,16,17,18);1-2,5,7H,3-4,6H2,(H2,15,16,17,18,19);1-2,5,7-8H,3-4,6H2,(H2,14,15,16,17,18).
What are the key properties of 2-chloro-8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;2-chloro-N-(furan-2-ylmethyl)-7-(2-methoxyethyl)pyrrolo[2,3-d]pyrimidin-4-amine;2-chloro-N-(furan-2-ylmethyl)-8-phenyl-7H-purin-6-amine;8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;N-(furan-2-ylmethyl)-5-pyridin-4-yl-7H-pyrrolo[2,3-d]pyrimidin-4-amine?
2-chloro-8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;2-chloro-N-(furan-2-ylmethyl)-7-(2-methoxyethyl)pyrrolo[2,3-d]pyrimidin-4-amine;2-chloro-N-(furan-2-ylmethyl)-8-phenyl-7H-purin-6-amine;8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;N-(furan-2-ylmethyl)-5-pyridin-4-yl-7H-pyrrolo[2,3-d]pyrimidin-4-amine has a molecular weight of 1468.83 g/mol, XLogP of 15.56, 22 rotatable bonds, 9 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;2-chloro-N-(furan-2-ylmethyl)-7-(2-methoxyethyl)pyrrolo[2,3-d]pyrimidin-4-amine;2-chloro-N-(furan-2-ylmethyl)-8-phenyl-7H-purin-6-amine;8-cyclopropyl-N-(furan-2-ylmethyl)-7H-purin-6-amine;N-(furan-2-ylmethyl)-5-pyridin-4-yl-7H-pyrrolo[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 160579145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).