6-amino-3-chloro-N-(1-ethylpyrazol-3-yl)pyridine-2-carboxamide

C11H12ClN5O — CID 114252338

IUPAC6-amino-3-chloro-N-(1-ethylpyrazol-3-yl)pyridine-2-carboxamide
SMILESCCn1ccc(NC(=O)c2nc(N)ccc2Cl)n1
InChIInChI=1S/C11H12ClN5O/c1-2-17-6-5-9(16-17)15-11(18)10-7(12)3-4-8(13)14-10/h3-6H,2H2,1H3,(H2,13,14)(H,15,16,18)
InChIKeyMLMZQVQIFVCGLD-UHFFFAOYSA-N
MW265.70 g/mol
LogP1.79
Rot. Bonds3

About 6-amino-3-chloro-N-(1-ethylpyrazol-3-yl)pyridine-2-carboxamide

6-amino-3-chloro-N-(1-ethylpyrazol-3-yl)pyridine-2-carboxamide (PubChem CID 114252338) has the molecular formula C11H12ClN5O and a molecular weight of 265.70 g/mol. Its IUPAC name is 6-amino-3-chloro-N-(1-ethylpyrazol-3-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-amino-3-chloro-N-(1-ethylpyrazol-3-yl)pyridine-2-carboxamide
PubChem CID114252338
Molecular FormulaC11H12ClN5O
Molecular Weight265.70 g/mol
Exact Mass265.07
IUPAC Name6-amino-3-chloro-N-(1-ethylpyrazol-3-yl)pyridine-2-carboxamide
SMILESCCn1ccc(NC(=O)c2nc(N)ccc2Cl)n1
InChIInChI=1S/C11H12ClN5O/c1-2-17-6-5-9(16-17)15-11(18)10-7(12)3-4-8(13)14-10/h3-6H,2H2,1H3,(H2,13,14)(H,15,16,18)
InChIKeyMLMZQVQIFVCGLD-UHFFFAOYSA-N
XLogP1.79
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.70
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2,6-dichloro-N-(1-ethylpyrazol-3-yl)pyridine-4-carboxamide
CID 114251518
6-amino-3-chloro-N-ethylpyridine-2-carboxamide
CID 62154853
3-N,4-N-bis(1-ethylpyrazol-3-yl)-1-methylpyrazole-3,4-dicarboxamide
CID 29097735
2-chloro-N-(1-ethylpyrazol-3-yl)-4,5-difluorobenzamide
CID 35286238
6-amino-3-chloro-N-methylpyridine-2-carboxamide
CID 62156050
N-(1-ethylpyrazol-3-yl)pyridine-2-carboxamide
CID 35286531
6-amino-3-chloro-N-(4-methylphenyl)pyridine-2-carboxamide
CID 55042017
3-amino-N-(1-ethylpyrazol-3-yl)-2-methylbenzamide
CID 114251301
5-amino-N-(1-ethylpyrazol-3-yl)-1-methylpyrazole-4-carboxamide
CID 114252333
N-[1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-1-ethylpyrazole-3-carboxamide
CID 19285284
6-amino-3-chloro-N-(5-fluoro-2-pyridinyl)pyridine-2-carboxamide
CID 65482280
6-amino-3-chloro-N-(2-methylpyrazol-3-yl)pyridine-2-carboxamide
CID 55041524

Frequently Asked Questions

What is the IUPAC name of 6-amino-3-chloro-N-(1-ethylpyrazol-3-yl)pyridine-2-carboxamide?
The IUPAC name of 6-amino-3-chloro-N-(1-ethylpyrazol-3-yl)pyridine-2-carboxamide (CID 114252338) is 6-amino-3-chloro-N-(1-ethylpyrazol-3-yl)pyridine-2-carboxamide.
What is the SMILES notation for 6-amino-3-chloro-N-(1-ethylpyrazol-3-yl)pyridine-2-carboxamide?
The canonical SMILES for 6-amino-3-chloro-N-(1-ethylpyrazol-3-yl)pyridine-2-carboxamide is CCn1ccc(NC(=O)c2nc(N)ccc2Cl)n1.
What is the InChIKey of 6-amino-3-chloro-N-(1-ethylpyrazol-3-yl)pyridine-2-carboxamide?
The InChIKey is MLMZQVQIFVCGLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClN5O/c1-2-17-6-5-9(16-17)15-11(18)10-7(12)3-4-8(13)14-10/h3-6H,2H2,1H3,(H2,13,14)(H,15,16,18).
What are the key properties of 6-amino-3-chloro-N-(1-ethylpyrazol-3-yl)pyridine-2-carboxamide?
6-amino-3-chloro-N-(1-ethylpyrazol-3-yl)pyridine-2-carboxamide has a molecular weight of 265.70 g/mol, XLogP of 1.79, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-3-chloro-N-(1-ethylpyrazol-3-yl)pyridine-2-carboxamide is sourced from PubChem (CID 114252338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).