4-chloro-6-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-carboxamide

C13H15ClN4O — CID 103803878

IUPAC4-chloro-6-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-carboxamide
SMILESCCCc1cc(NC(=O)c2cnc(C)cc2Cl)n[nH]1
InChIInChI=1S/C13H15ClN4O/c1-3-4-9-6-12(18-17-9)16-13(19)10-7-15-8(2)5-11(10)14/h5-7H,3-4H2,1-2H3,(H2,16,17,18,19)
InChIKeyIPSUICFYDPDZOE-UHFFFAOYSA-N
MW278.74 g/mol
LogP2.97
Rot. Bonds4

About 4-chloro-6-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-carboxamide

4-chloro-6-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-carboxamide (PubChem CID 103803878) has the molecular formula C13H15ClN4O and a molecular weight of 278.74 g/mol. Its IUPAC name is 4-chloro-6-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-chloro-6-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-carboxamide
PubChem CID103803878
Molecular FormulaC13H15ClN4O
Molecular Weight278.74 g/mol
Exact Mass278.09
IUPAC Name4-chloro-6-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-carboxamide
SMILESCCCc1cc(NC(=O)c2cnc(C)cc2Cl)n[nH]1
InChIInChI=1S/C13H15ClN4O/c1-3-4-9-6-12(18-17-9)16-13(19)10-7-15-8(2)5-11(10)14/h5-7H,3-4H2,1-2H3,(H2,16,17,18,19)
InChIKeyIPSUICFYDPDZOE-UHFFFAOYSA-N
XLogP2.97
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.74
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-amino-2,3-dichloro-N-(5-propyl-1H-pyrazol-3-yl)benzamide
CID 107185838
2,5-dimethyl-N-(5-propyl-1H-pyrazol-3-yl)thiophene-3-carboxamide
CID 113233981
4-fluoro-2-methyl-N-(5-propyl-1H-pyrazol-3-yl)benzamide
CID 112702658
4-hydroxy-2-methyl-N-(5-propyl-1H-pyrazol-3-yl)benzamide
CID 103865483
1,3-dimethyl-N-(5-propyl-1H-pyrazol-3-yl)pyrazole-4-carboxamide
CID 113235417
3-chloro-N-(5-propyl-1H-pyrazol-3-yl)propanamide
CID 104617718
4-chloro-6-methyl-N-(2-propylphenyl)pyridine-3-carboxamide
CID 81226564
3-oxo-3-[(5-propyl-1H-pyrazol-3-yl)amino]propanoic acid
CID 104621777
4-chloro-6-methyl-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide
CID 81225554
2,4,6-trimethyl-N-(5-propyl-1H-pyrazol-3-yl)benzamide
CID 115778074
2-iodo-N-(5-propyl-1H-pyrazol-3-yl)benzamide
CID 113233988
2-bromo-N-(5-propyl-1H-pyrazol-3-yl)benzamide
CID 113233987

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-carboxamide?
The IUPAC name of 4-chloro-6-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-carboxamide (CID 103803878) is 4-chloro-6-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-carboxamide.
What is the SMILES notation for 4-chloro-6-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-carboxamide?
The canonical SMILES for 4-chloro-6-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-carboxamide is CCCc1cc(NC(=O)c2cnc(C)cc2Cl)n[nH]1.
What is the InChIKey of 4-chloro-6-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-carboxamide?
The InChIKey is IPSUICFYDPDZOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN4O/c1-3-4-9-6-12(18-17-9)16-13(19)10-7-15-8(2)5-11(10)14/h5-7H,3-4H2,1-2H3,(H2,16,17,18,19).
What are the key properties of 4-chloro-6-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-carboxamide?
4-chloro-6-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-carboxamide has a molecular weight of 278.74 g/mol, XLogP of 2.97, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-carboxamide is sourced from PubChem (CID 103803878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).