5-methyl-N-(2-pyrrolidin-1-yl-3-pyridinyl)-1H-pyrazole-4-carboxamide

C14H17N5O — CID 63998437

IUPAC5-methyl-N-(2-pyrrolidin-1-yl-3-pyridinyl)-1H-pyrazole-4-carboxamide
SMILESCc1[nH]ncc1C(=O)Nc1cccnc1N1CCCC1
InChIInChI=1S/C14H17N5O/c1-10-11(9-16-18-10)14(20)17-12-5-4-6-15-13(12)19-7-2-3-8-19/h4-6,9H,2-3,7-8H2,1H3,(H,16,18)(H,17,20)
InChIKeyXLDRBFYRLSJHJO-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.97
Rot. Bonds3

About 5-methyl-N-(2-pyrrolidin-1-yl-3-pyridinyl)-1H-pyrazole-4-carboxamide

5-methyl-N-(2-pyrrolidin-1-yl-3-pyridinyl)-1H-pyrazole-4-carboxamide (PubChem CID 63998437) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is 5-methyl-N-(2-pyrrolidin-1-yl-3-pyridinyl)-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(2-pyrrolidin-1-yl-3-pyridinyl)-1H-pyrazole-4-carboxamide
PubChem CID63998437
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC Name5-methyl-N-(2-pyrrolidin-1-yl-3-pyridinyl)-1H-pyrazole-4-carboxamide
SMILESCc1[nH]ncc1C(=O)Nc1cccnc1N1CCCC1
InChIInChI=1S/C14H17N5O/c1-10-11(9-16-18-10)14(20)17-12-5-4-6-15-13(12)19-7-2-3-8-19/h4-6,9H,2-3,7-8H2,1H3,(H,16,18)(H,17,20)
InChIKeyXLDRBFYRLSJHJO-UHFFFAOYSA-N
XLogP1.97
TPSA73.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-2-methyl-N-(2-piperidin-1-yl-3-pyridinyl)pyrimidine-5-carboxamide
CID 167907212
2-iodo-N-(2-pyrrolidin-1-yl-3-pyridinyl)benzamide
CID 60788894
N-(2-acetylphenyl)-5-methyl-1H-pyrazole-4-carboxamide
CID 63998634
2-methoxy-N-(2-pyrrolidin-1-yl-3-pyridinyl)propanamide
CID 47308006
2-(azetidin-3-ylidene)-N-(2-pyrrolidin-1-yl-3-pyridinyl)propanamide
CID 116675182
(2R)-2-amino-3-methyl-N-(2-pyrrolidin-1-yl-3-pyridinyl)butanamide
CID 79011469
2-(azepan-1-yl)-N-(2-chlorophenyl)pyridine-3-carboxamide
CID 84576263
5-methyl-N-(2-piperidin-1-yl-3-pyridinyl)-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide
CID 55977893
2-(azepan-1-yl)-N-(5-chloro-2-methylphenyl)pyridine-3-carboxamide
CID 84576944
2-methylsulfanyl-N-(2-piperidin-1-yl-3-pyridinyl)propanamide
CID 47354331
6-(4-methylphenyl)-1-propan-2-yl-N-(2-pyrrolidin-1-yl-3-pyridinyl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 55780060
N-[2-(bromomethyl)phenyl]-5-methyl-1H-pyrazole-4-carboxamide
CID 114309775

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(2-pyrrolidin-1-yl-3-pyridinyl)-1H-pyrazole-4-carboxamide?
The IUPAC name of 5-methyl-N-(2-pyrrolidin-1-yl-3-pyridinyl)-1H-pyrazole-4-carboxamide (CID 63998437) is 5-methyl-N-(2-pyrrolidin-1-yl-3-pyridinyl)-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 5-methyl-N-(2-pyrrolidin-1-yl-3-pyridinyl)-1H-pyrazole-4-carboxamide?
The canonical SMILES for 5-methyl-N-(2-pyrrolidin-1-yl-3-pyridinyl)-1H-pyrazole-4-carboxamide is Cc1[nH]ncc1C(=O)Nc1cccnc1N1CCCC1.
What is the InChIKey of 5-methyl-N-(2-pyrrolidin-1-yl-3-pyridinyl)-1H-pyrazole-4-carboxamide?
The InChIKey is XLDRBFYRLSJHJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O/c1-10-11(9-16-18-10)14(20)17-12-5-4-6-15-13(12)19-7-2-3-8-19/h4-6,9H,2-3,7-8H2,1H3,(H,16,18)(H,17,20).
What are the key properties of 5-methyl-N-(2-pyrrolidin-1-yl-3-pyridinyl)-1H-pyrazole-4-carboxamide?
5-methyl-N-(2-pyrrolidin-1-yl-3-pyridinyl)-1H-pyrazole-4-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 1.97, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(2-pyrrolidin-1-yl-3-pyridinyl)-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 63998437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).