N-(1-cyclopropylethyl)-5-methyl-7-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(1-cyclopropylethyl)-7-methyl-5-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide

C36H38N10O2 — CID 159473263

IUPACN-(1-cyclopropylethyl)-5-methyl-7-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(1-cyclopropylethyl)-7-methyl-5-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cc(-c2ccccn2)n2ncc(C(=O)NC(C)C3CC3)c2n1.Cc1cc(-c2ccccn2)nc2c(C(=O)NC(C)C3CC3)cnn12
InChIInChI=1S/2C18H19N5O/c1-11-9-16(15-5-3-4-8-19-15)22-17-14(10-20-23(11)17)18(24)21-12(2)13-6-7-13;1-11-9-16(15-5-3-4-8-19-15)23-17(21-11)14(10-20-23)18(24)22-12(2)13-6-7-13/h3-5,8-10,12-13H,6-7H2,1-2H3,(H,21,24);3-5,8-10,12-13H,6-7H2,1-2H3,(H,22,24)
InChIKeyLWBGWWWNZLZEPD-UHFFFAOYSA-N
MW642.77 g/mol
LogP5.26
Rot. Bonds8

About N-(1-cyclopropylethyl)-5-methyl-7-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(1-cyclopropylethyl)-7-methyl-5-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide

N-(1-cyclopropylethyl)-5-methyl-7-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(1-cyclopropylethyl)-7-methyl-5-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 159473263) has the molecular formula C36H38N10O2 and a molecular weight of 642.77 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-5-methyl-7-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(1-cyclopropylethyl)-7-methyl-5-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-5-methyl-7-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(1-cyclopropylethyl)-7-methyl-5-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID159473263
Molecular FormulaC36H38N10O2
Molecular Weight642.77 g/mol
Exact Mass642.32
IUPAC NameN-(1-cyclopropylethyl)-5-methyl-7-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(1-cyclopropylethyl)-7-methyl-5-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cc(-c2ccccn2)n2ncc(C(=O)NC(C)C3CC3)c2n1.Cc1cc(-c2ccccn2)nc2c(C(=O)NC(C)C3CC3)cnn12
InChIInChI=1S/2C18H19N5O/c1-11-9-16(15-5-3-4-8-19-15)22-17-14(10-20-23(11)17)18(24)21-12(2)13-6-7-13;1-11-9-16(15-5-3-4-8-19-15)23-17(21-11)14(10-20-23)18(24)22-12(2)13-6-7-13/h3-5,8-10,12-13H,6-7H2,1-2H3,(H,21,24);3-5,8-10,12-13H,6-7H2,1-2H3,(H,22,24)
InChIKeyLWBGWWWNZLZEPD-UHFFFAOYSA-N
XLogP5.26
TPSA144.36 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds8
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500642.77
LogP ≤ 55.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

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Related Compounds

N-[(1R)-1-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 98331279
N-[(2R)-butan-2-yl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 1097804
5,7-dimethyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
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N-(4-anilinophenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 166204350
ethyl 2-[(5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]propanoate
CID 47494468
N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-5-(6-isocyano-3-pyridinyl)-7-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 140822128
N-[1-(3,4-difluorophenyl)ethyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 46535131
N-(2-aminophenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 43621544
5,7-diphenyl-N-[(1S)-1-phenylethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 92750093
N-[(2-fluorophenyl)-(1-methylimidazol-2-yl)methyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 42889546
N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-5-(5-isocyano-3-pyridinyl)-7-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 140822139
N-[2-hydroxy-1-(4-methylphenyl)ethyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-5-methyl-7-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(1-cyclopropylethyl)-7-methyl-5-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-(1-cyclopropylethyl)-5-methyl-7-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(1-cyclopropylethyl)-7-methyl-5-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 159473263) is N-(1-cyclopropylethyl)-5-methyl-7-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(1-cyclopropylethyl)-7-methyl-5-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-(1-cyclopropylethyl)-5-methyl-7-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(1-cyclopropylethyl)-7-methyl-5-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-(1-cyclopropylethyl)-5-methyl-7-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(1-cyclopropylethyl)-7-methyl-5-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide is Cc1cc(-c2ccccn2)n2ncc(C(=O)NC(C)C3CC3)c2n1.Cc1cc(-c2ccccn2)nc2c(C(=O)NC(C)C3CC3)cnn12.
What is the InChIKey of N-(1-cyclopropylethyl)-5-methyl-7-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(1-cyclopropylethyl)-7-methyl-5-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is LWBGWWWNZLZEPD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C18H19N5O/c1-11-9-16(15-5-3-4-8-19-15)22-17-14(10-20-23(11)17)18(24)21-12(2)13-6-7-13;1-11-9-16(15-5-3-4-8-19-15)23-17(21-11)14(10-20-23)18(24)22-12(2)13-6-7-13/h3-5,8-10,12-13H,6-7H2,1-2H3,(H,21,24);3-5,8-10,12-13H,6-7H2,1-2H3,(H,22,24).
What are the key properties of N-(1-cyclopropylethyl)-5-methyl-7-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(1-cyclopropylethyl)-7-methyl-5-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-(1-cyclopropylethyl)-5-methyl-7-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(1-cyclopropylethyl)-7-methyl-5-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 642.77 g/mol, XLogP of 5.26, 8 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-5-methyl-7-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(1-cyclopropylethyl)-7-methyl-5-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 159473263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).