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

C13H17N5O — CID 62076548

IUPAC4-amino-N-(5-methyl-2-pyridinyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
SMILESCc1ccc(NC(=O)c2n[nH]c(C(C)C)c2N)nc1
InChIInChI=1S/C13H17N5O/c1-7(2)11-10(14)12(18-17-11)13(19)16-9-5-4-8(3)6-15-9/h4-7H,14H2,1-3H3,(H,17,18)(H,15,16,19)
InChIKeyFNFKJCYMCJPRFQ-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.07
Rot. Bonds3

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

4-amino-N-(5-methyl-2-pyridinyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide (PubChem CID 62076548) has the molecular formula C13H17N5O and a molecular weight of 259.31 g/mol. Its IUPAC name is 4-amino-N-(5-methyl-2-pyridinyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(5-methyl-2-pyridinyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
PubChem CID62076548
Molecular FormulaC13H17N5O
Molecular Weight259.31 g/mol
Exact Mass259.14
IUPAC Name4-amino-N-(5-methyl-2-pyridinyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
SMILESCc1ccc(NC(=O)c2n[nH]c(C(C)C)c2N)nc1
InChIInChI=1S/C13H17N5O/c1-7(2)11-10(14)12(18-17-11)13(19)16-9-5-4-8(3)6-15-9/h4-7H,14H2,1-3H3,(H,17,18)(H,15,16,19)
InChIKeyFNFKJCYMCJPRFQ-UHFFFAOYSA-N
XLogP2.07
TPSA96.69 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

5-amino-N-(5-methyl-2-pyridinyl)-2-propan-2-ylpyrimidine-4-carboxamide
CID 62151652
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CID 18106776
N-(4-acetylphenyl)-4-amino-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 62077234
4-amino-N-(3-hydroxy-4-methylphenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 107699370
4-amino-N-(2-ethylphenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 62077044
4-amino-5-propan-2-yl-N-(2-propan-2-ylpyrazol-3-yl)-1H-pyrazole-3-carboxamide
CID 62077396
(2S)-2-amino-N-(5-methyl-2-pyridinyl)propanamide
CID 61147752
4-amino-N-(3-bromo-4-fluorophenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 104775377
4-amino-N-(2-ethoxyphenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 62077048
4-amino-N-(1H-indazol-4-yl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 62075734
N'-(5-methyl-2-pyridinyl)oxamide
CID 23087857
4-amino-N-(4-bromo-2,6-difluorophenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 65468469

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(5-methyl-2-pyridinyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-N-(5-methyl-2-pyridinyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide (CID 62076548) is 4-amino-N-(5-methyl-2-pyridinyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-(5-methyl-2-pyridinyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-N-(5-methyl-2-pyridinyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide is Cc1ccc(NC(=O)c2n[nH]c(C(C)C)c2N)nc1.
What is the InChIKey of 4-amino-N-(5-methyl-2-pyridinyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide?
The InChIKey is FNFKJCYMCJPRFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O/c1-7(2)11-10(14)12(18-17-11)13(19)16-9-5-4-8(3)6-15-9/h4-7H,14H2,1-3H3,(H,17,18)(H,15,16,19).
What are the key properties of 4-amino-N-(5-methyl-2-pyridinyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide?
4-amino-N-(5-methyl-2-pyridinyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide has a molecular weight of 259.31 g/mol, XLogP of 2.07, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(5-methyl-2-pyridinyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 62076548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).