5-chloro-6-[(3-ethyl-1-methylpyrazol-4-yl)methylamino]pyridine-3-carboxamide

C13H16ClN5O — CID 133444908

IUPAC5-chloro-6-[(3-ethyl-1-methylpyrazol-4-yl)methylamino]pyridine-3-carboxamide
SMILESCCc1nn(C)cc1CNc1ncc(C(N)=O)cc1Cl
InChIInChI=1S/C13H16ClN5O/c1-3-11-9(7-19(2)18-11)6-17-13-10(14)4-8(5-16-13)12(15)20/h4-5,7H,3,6H2,1-2H3,(H2,15,20)(H,16,17)
InChIKeyWSAXGTPWQXHFBU-UHFFFAOYSA-N
MW293.76 g/mol
LogP1.74
Rot. Bonds5

About 5-chloro-6-[(3-ethyl-1-methylpyrazol-4-yl)methylamino]pyridine-3-carboxamide

5-chloro-6-[(3-ethyl-1-methylpyrazol-4-yl)methylamino]pyridine-3-carboxamide (PubChem CID 133444908) has the molecular formula C13H16ClN5O and a molecular weight of 293.76 g/mol. Its IUPAC name is 5-chloro-6-[(3-ethyl-1-methylpyrazol-4-yl)methylamino]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-6-[(3-ethyl-1-methylpyrazol-4-yl)methylamino]pyridine-3-carboxamide
PubChem CID133444908
Molecular FormulaC13H16ClN5O
Molecular Weight293.76 g/mol
Exact Mass293.10
IUPAC Name5-chloro-6-[(3-ethyl-1-methylpyrazol-4-yl)methylamino]pyridine-3-carboxamide
SMILESCCc1nn(C)cc1CNc1ncc(C(N)=O)cc1Cl
InChIInChI=1S/C13H16ClN5O/c1-3-11-9(7-19(2)18-11)6-17-13-10(14)4-8(5-16-13)12(15)20/h4-5,7H,3,6H2,1-2H3,(H2,15,20)(H,16,17)
InChIKeyWSAXGTPWQXHFBU-UHFFFAOYSA-N
XLogP1.74
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.76
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-6-[(1-methyl-3-phenylpyrazol-4-yl)methylamino]pyridine-3-carboxamide
CID 133449160
4-chloro-3-[(3-ethyl-1-methylpyrazol-4-yl)methylamino]benzamide
CID 115989561
5,6-dichloro-N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide
CID 115888256
3-chloro-4-[(3-ethyl-1-methylpyrazol-4-yl)methylamino]benzoic acid
CID 115991762
5-chloro-6-[(2-methyl-2-methylsulfanylpropyl)amino]pyridine-3-carboxamide
CID 133327417
4-N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-5-methylpyrimidine-2,4-diamine
CID 112672208
5-chloro-6-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylamino]pyridine-3-carboxamide
CID 56816532
6-[(4-bromophenyl)methylamino]-5-chloropyridine-3-carboxamide
CID 133292879
5-chloro-6-[(1-methyl-1,2,4-triazol-3-yl)methylamino]pyridine-3-carboxylic acid
CID 114125777
5-chloro-6-[(2-methylpyrimidin-4-yl)methylamino]pyridine-3-carboxamide
CID 47059518
5-bromo-N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]pyrimidin-4-amine
CID 112549960
6-chloro-N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-5-nitropyrimidin-4-amine
CID 115991394

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-[(3-ethyl-1-methylpyrazol-4-yl)methylamino]pyridine-3-carboxamide?
The IUPAC name of 5-chloro-6-[(3-ethyl-1-methylpyrazol-4-yl)methylamino]pyridine-3-carboxamide (CID 133444908) is 5-chloro-6-[(3-ethyl-1-methylpyrazol-4-yl)methylamino]pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-6-[(3-ethyl-1-methylpyrazol-4-yl)methylamino]pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-6-[(3-ethyl-1-methylpyrazol-4-yl)methylamino]pyridine-3-carboxamide is CCc1nn(C)cc1CNc1ncc(C(N)=O)cc1Cl.
What is the InChIKey of 5-chloro-6-[(3-ethyl-1-methylpyrazol-4-yl)methylamino]pyridine-3-carboxamide?
The InChIKey is WSAXGTPWQXHFBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16ClN5O/c1-3-11-9(7-19(2)18-11)6-17-13-10(14)4-8(5-16-13)12(15)20/h4-5,7H,3,6H2,1-2H3,(H2,15,20)(H,16,17).
What are the key properties of 5-chloro-6-[(3-ethyl-1-methylpyrazol-4-yl)methylamino]pyridine-3-carboxamide?
5-chloro-6-[(3-ethyl-1-methylpyrazol-4-yl)methylamino]pyridine-3-carboxamide has a molecular weight of 293.76 g/mol, XLogP of 1.74, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-[(3-ethyl-1-methylpyrazol-4-yl)methylamino]pyridine-3-carboxamide is sourced from PubChem (CID 133444908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).