tert-butyl N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-prop-2-enylcarbamate;tert-butyl N-methyl-N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate;tert-butyl N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate

C73H93ClF2N22O10 — CID 157341839

IUPACtert-butyl N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-prop-2-enylcarbamate;tert-butyl N-methyl-N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate;tert-butyl N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate
SMILESC=CCN(C(=O)OC(C)(C)C)c1cn(-c2cncc(F)c2)nc1C.CN(C(=O)OC(C)(C)C)c1cn(-c2cccnc2)nc1Cl.Cc1nn(-c2cncc(F)c2)cc1N(C)C(=O)OC(C)(C)C.Cc1nn(-c2cncnc2)cc1N(C)C(=O)OC(C)(C)C.Cc1nn(-c2cncnc2)cc1NC(=O)OC(C)(C)C
InChIInChI=1S/C17H21FN4O2.C15H19FN4O2.C14H17ClN4O2.C14H19N5O2.C13H17N5O2/c1-6-7-21(16(23)24-17(3,4)5)15-11-22(20-12(15)2)14-8-13(18)9-19-10-14;1-10-13(19(5)14(21)22-15(2,3)4)9-20(18-10)12-6-11(16)7-17-8-12;1-14(2,3)21-13(20)18(4)11-9-19(17-12(11)15)10-6-5-7-16-8-10;1-10-12(18(5)13(20)21-14(2,3)4)8-19(17-10)11-6-15-9-16-7-11;1-9-11(16-12(19)20-13(2,3)4)7-18(17-9)10-5-14-8-15-6-10/h6,8-11H,1,7H2,2-5H3;6-9H,1-5H3;5-9H,1-4H3;6-9H,1-5H3;5-8H,1-4H3,(H,16,19)
InChIKeyBGMHFHVWWUDIDK-UHFFFAOYSA-N
MW1512.14 g/mol
LogP14.68
Rot. Bonds12

About tert-butyl N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-prop-2-enylcarbamate;tert-butyl N-methyl-N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate;tert-butyl N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate

tert-butyl N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-prop-2-enylcarbamate;tert-butyl N-methyl-N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate;tert-butyl N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate (PubChem CID 157341839) has the molecular formula C73H93ClF2N22O10 and a molecular weight of 1512.14 g/mol. Its IUPAC name is tert-butyl N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-prop-2-enylcarbamate;tert-butyl N-methyl-N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate;tert-butyl N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate.

Molecular Properties

Compound Nametert-butyl N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-prop-2-enylcarbamate;tert-butyl N-methyl-N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate;tert-butyl N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate
PubChem CID157341839
Molecular FormulaC73H93ClF2N22O10
Molecular Weight1512.14 g/mol
Exact Mass1510.71
IUPAC Nametert-butyl N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-prop-2-enylcarbamate;tert-butyl N-methyl-N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate;tert-butyl N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate
SMILESC=CCN(C(=O)OC(C)(C)C)c1cn(-c2cncc(F)c2)nc1C.CN(C(=O)OC(C)(C)C)c1cn(-c2cccnc2)nc1Cl.Cc1nn(-c2cncc(F)c2)cc1N(C)C(=O)OC(C)(C)C.Cc1nn(-c2cncnc2)cc1N(C)C(=O)OC(C)(C)C.Cc1nn(-c2cncnc2)cc1NC(=O)OC(C)(C)C
InChIInChI=1S/C17H21FN4O2.C15H19FN4O2.C14H17ClN4O2.C14H19N5O2.C13H17N5O2/c1-6-7-21(16(23)24-17(3,4)5)15-11-22(20-12(15)2)14-8-13(18)9-19-10-14;1-10-13(19(5)14(21)22-15(2,3)4)9-20(18-10)12-6-11(16)7-17-8-12;1-14(2,3)21-13(20)18(4)11-9-19(17-12(11)15)10-6-5-7-16-8-10;1-10-12(18(5)13(20)21-14(2,3)4)8-19(17-10)11-6-15-9-16-7-11;1-9-11(16-12(19)20-13(2,3)4)7-18(17-9)10-5-14-8-15-6-10/h6,8-11H,1,7H2,2-5H3;6-9H,1-5H3;5-9H,1-4H3;6-9H,1-5H3;5-8H,1-4H3,(H,16,19)
InChIKeyBGMHFHVWWUDIDK-UHFFFAOYSA-N
XLogP14.68
TPSA335.82 Ų
H-Bond Donors1
H-Bond Acceptors27
Rotatable Bonds12
Heavy Atoms108
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001512.14
LogP ≤ 514.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1027

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze tert-butyl N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-prop-2-enylcarbamate;tert-butyl N-methyl-N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate;tert-butyl N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate with MolForge

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Related Compounds

tert-butyl 4-[6-[[2-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetyl]amino]-3-pyridinyl]piperazine-1-carboxylate;tert-butyl 4-[6-[[2-[4-[2-(trifluoromethyl)-4-pyridinyl]imidazol-1-yl]acetyl]amino]-3-pyridinyl]piperazine-1-carboxylate;tert-butyl 4-[6-[[2-[4-[2-(trifluoromethyl)-4-pyridinyl]pyrazol-1-yl]acetyl]amino]-3-pyridinyl]piperazine-1-carboxylate;2-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;N-(5-pyrazin-2-yl-2-pyridinyl)-2-(4-pyridin-4-ylimidazol-1-yl)acetamide;N-(5-pyrazin-2-yl-2-pyridinyl)-2-[4-[2-(trifluoromethyl)-4-pyridinyl]imidazol-1-yl]acetamide;N-(5-pyrimidin-4-yl-2-pyridinyl)-2-[4-[2-(trifluoromethyl)-4-pyridinyl]imidazol-1-yl]acetamide;N-(5-pyrimidin-5-yl-2-pyridinyl)-2-[4-[2-(trifluoromethyl)-4-pyridinyl]imidazol-1-yl]acetamide
CID 157175782
tert-butyl N-methyl-N-(1-methyl-3-pyridin-3-ylpyrazol-5-yl)carbamate;tert-butyl N-methyl-N-(1-methyl-3-pyrimidin-5-ylpyrazol-5-yl)carbamate;3-tert-butyl-1-methyl-1-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)urea;tert-butyl N-(1-methyl-3-pyridin-3-ylpyrazol-5-yl)carbamate;tert-butyl N-methyl-N-[1-pyridin-3-yl-3-(trifluoromethyl)pyrazol-4-yl]carbamate;tert-butyl N-methyl-N-[1-pyrimidin-5-yl-3-(trifluoromethyl)pyrazol-4-yl]carbamate;tert-butyl N-[1-pyridin-3-yl-3-(trifluoromethyl)pyrazol-4-yl]carbamate;tert-butyl N-[1-pyrimidin-5-yl-3-(trifluoromethyl)pyrazol-4-yl]carbamate
CID 157286162
tert-butyl N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-(4-fluorobutyl)carbamate;tert-butyl N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-(4,4,4-trifluorobutyl)carbamate;N'-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)cyclopropanecarboximidamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-(cyclopropylmethyl)-3,3,3-trifluoropropanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-3,3,3-trifluoropropanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-3,3,3-trifluoro-N-methylpropanamide
CID 158323134
tert-butyl N-(2-chloroethyl)-N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)carbamate;tert-butyl N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-(2,2-difluoroethyl)carbamate;tert-butyl N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-(2,2,2-trifluoroethyl)carbamate;1-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-1-ethyl-3-methyl-3-(2,2,2-trifluoroethyl)urea;1-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-1-ethyl-3-(4,4,4-trifluorobutyl)urea;1-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-1-ethyl-3-(3,3,3-trifluoropropyl)urea;S-(3,3,3-trifluoropropyl) N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethylcarbamothioate
CID 158855837
4-(1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl)-6-(1,3-dimethylpyrazol-4-yl)pyrimidin-2-amine;tert-butyl 2,3,4,4a,5,6,7,7a-octahydropyrrolo[3,4-b]pyridine-1-carboxylate;tert-butyl 6-[2-amino-6-(1,3-dimethylpyrazol-4-yl)pyrimidin-4-yl]-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridine-1-carboxylate;4-chloro-6-(1,3-dimethylpyrazol-4-yl)pyrimidin-2-amine;deuterioethane;2,2,2-trifluoroacetaldehyde
CID 158914021
Tert-butyl 4-[4-[1-[(6-chloroimidazo[1,2-b]pyridazin-3-yl)methyl]pyrazolo[4,5-b]pyridin-6-yl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[3-[[6-[1-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]pyrazol-4-yl]pyrazolo[4,5-b]pyridin-1-yl]methyl]imidazo[1,2-b]pyridazin-6-yl]pyrazol-1-yl]piperidine-1-carboxylate;tert-butyl 4-[4-[1-[[6-(trifluoromethyl)imidazo[1,2-b]pyridazin-3-yl]methyl]pyrazolo[4,5-b]pyridin-6-yl]pyrazol-1-yl]piperidine-1-carboxylate
CID 160026379
tert-butyl N-but-2-ynyl-N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)carbamate;4-chloro-N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)butanamide;1-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-1-ethyl-3-(2,2,2-trifluoroethyl)urea;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-3-imidazol-1-yl-N-methylpropanamide;1-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-3-methylidenepyrrolidin-2-one;1-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)pyrrolidin-2-one;S-(2,2,2-trifluoroethyl) N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethylcarbamothioate
CID 160641274
N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(tetrazol-2-yl)acetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-3-(tetrazol-1-yl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-3-(1,2,4-triazol-1-yl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-3-imidazol-1-yl-N-methylpropanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-methyl-3-(tetrazol-1-yl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-methyl-2-(triazol-1-yl)acetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-methyl-3-(1,2,4-triazol-1-yl)propanamide
CID 158051308
tert-butyl (3R)-3-[[[5-amino-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate;tert-butyl (3R)-3-(aminomethyl)piperidine-1-carboxylate;tert-butyl (3R)-3-[[2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-8-oxo-7H-purin-9-yl]methyl]piperidine-1-carboxylate;[4-chloro-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-5-yl]-oxidoazanium;[2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-4-[[(3R)-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]methylamino]pyrimidin-5-yl]-oxidoazanium;dihydrate
CID 158200603
tert-butyl (3S)-3-[[[5-amino-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate;tert-butyl (3S)-3-(aminomethyl)piperidine-1-carboxylate;tert-butyl (3S)-3-[[2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-8-oxo-7H-purin-9-yl]methyl]piperidine-1-carboxylate;[4-chloro-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-5-yl]-oxidoazanium;[2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-4-[[(3S)-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]methylamino]pyrimidin-5-yl]-oxidoazanium;dihydrate
CID 158200604
Tert-butyl 5-[2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]pyrimidin-5-yl]-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate;3-[5-(2,5-diazabicyclo[2.2.1]heptan-2-yl)pyrimidin-2-yl]-1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridine;1-[(2-fluorophenyl)methyl]-3-[5-(5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl)pyrimidin-2-yl]pyrazolo[5,4-b]pyridine
CID 158711213
tert-butyl 3-(5-fluoro-4-methylpyrimidin-2-yl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;3-chloro-4-fluoroaniline;2-chloro-5-fluoro-4-methylpyrimidine;N-(3-chloro-4-fluorophenyl)-3-(5-fluoro-4-methylpyrimidin-2-yl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide;3-(5-fluoro-4-methylpyrimidin-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine
CID 158714786

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-prop-2-enylcarbamate;tert-butyl N-methyl-N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate;tert-butyl N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate?
The IUPAC name of tert-butyl N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-prop-2-enylcarbamate;tert-butyl N-methyl-N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate;tert-butyl N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate (CID 157341839) is tert-butyl N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-prop-2-enylcarbamate;tert-butyl N-methyl-N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate;tert-butyl N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate.
What is the SMILES notation for tert-butyl N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-prop-2-enylcarbamate;tert-butyl N-methyl-N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate;tert-butyl N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate?
The canonical SMILES for tert-butyl N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-prop-2-enylcarbamate;tert-butyl N-methyl-N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate;tert-butyl N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate is C=CCN(C(=O)OC(C)(C)C)c1cn(-c2cncc(F)c2)nc1C.CN(C(=O)OC(C)(C)C)c1cn(-c2cccnc2)nc1Cl.Cc1nn(-c2cncc(F)c2)cc1N(C)C(=O)OC(C)(C)C.Cc1nn(-c2cncnc2)cc1N(C)C(=O)OC(C)(C)C.Cc1nn(-c2cncnc2)cc1NC(=O)OC(C)(C)C.
What is the InChIKey of tert-butyl N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-prop-2-enylcarbamate;tert-butyl N-methyl-N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate;tert-butyl N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate?
The InChIKey is BGMHFHVWWUDIDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21FN4O2.C15H19FN4O2.C14H17ClN4O2.C14H19N5O2.C13H17N5O2/c1-6-7-21(16(23)24-17(3,4)5)15-11-22(20-12(15)2)14-8-13(18)9-19-10-14;1-10-13(19(5)14(21)22-15(2,3)4)9-20(18-10)12-6-11(16)7-17-8-12;1-14(2,3)21-13(20)18(4)11-9-19(17-12(11)15)10-6-5-7-16-8-10;1-10-12(18(5)13(20)21-14(2,3)4)8-19(17-10)11-6-15-9-16-7-11;1-9-11(16-12(19)20-13(2,3)4)7-18(17-9)10-5-14-8-15-6-10/h6,8-11H,1,7H2,2-5H3;6-9H,1-5H3;5-9H,1-4H3;6-9H,1-5H3;5-8H,1-4H3,(H,16,19).
What are the key properties of tert-butyl N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-prop-2-enylcarbamate;tert-butyl N-methyl-N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate;tert-butyl N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate?
tert-butyl N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-prop-2-enylcarbamate;tert-butyl N-methyl-N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate;tert-butyl N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate has a molecular weight of 1512.14 g/mol, XLogP of 14.68, 12 rotatable bonds, 1 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-methylcarbamate;tert-butyl N-[1-(5-fluoro-3-pyridinyl)-3-methylpyrazol-4-yl]-N-prop-2-enylcarbamate;tert-butyl N-methyl-N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate;tert-butyl N-(3-methyl-1-pyrimidin-5-ylpyrazol-4-yl)carbamate is sourced from PubChem (CID 157341839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).