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

C13H20ClN3O — CID 55257710

IUPAC6-amino-3-chloro-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide
SMILESCCC(CC)C(C)NC(=O)c1nc(N)ccc1Cl
InChIInChI=1S/C13H20ClN3O/c1-4-9(5-2)8(3)16-13(18)12-10(14)6-7-11(15)17-12/h6-9H,4-5H2,1-3H3,(H2,15,17)(H,16,18)
InChIKeyQQNUWPDFFJDMNN-UHFFFAOYSA-N
MW269.78 g/mol
LogP2.87
Rot. Bonds5

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

6-amino-3-chloro-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide (PubChem CID 55257710) has the molecular formula C13H20ClN3O and a molecular weight of 269.78 g/mol. Its IUPAC name is 6-amino-3-chloro-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-amino-3-chloro-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide
PubChem CID55257710
Molecular FormulaC13H20ClN3O
Molecular Weight269.78 g/mol
Exact Mass269.13
IUPAC Name6-amino-3-chloro-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide
SMILESCCC(CC)C(C)NC(=O)c1nc(N)ccc1Cl
InChIInChI=1S/C13H20ClN3O/c1-4-9(5-2)8(3)16-13(18)12-10(14)6-7-11(15)17-12/h6-9H,4-5H2,1-3H3,(H2,15,17)(H,16,18)
InChIKeyQQNUWPDFFJDMNN-UHFFFAOYSA-N
XLogP2.87
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.78
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-3-chloro-N-ethylpyridine-2-carboxamide
CID 62154853
6-amino-3-chloro-N-[1-(diethylamino)propan-2-yl]pyridine-2-carboxamide
CID 62161278
6-amino-3-chloro-N-(2-methylpropyl)pyridine-2-carboxamide
CID 62156560
6-amino-3-chloro-N-(4-methylsulfanylbutan-2-yl)pyridine-2-carboxamide
CID 113478192
6-amino-3-chloro-N-methylpyridine-2-carboxamide
CID 62156050
6-amino-3-chloro-N-(4-phenylbutan-2-yl)pyridine-2-carboxamide
CID 62186305
6-amino-3-chloro-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyridine-2-carboxamide
CID 106389792
3-chloro-6-hydrazinyl-N-(3-methylpentan-2-yl)pyridine-2-carboxamide
CID 62249778
6-amino-3-chloro-N-(1-thiophen-2-ylethyl)pyridine-2-carboxamide
CID 62155473
6-amino-3-chloro-N-(2,2-dimethylpropyl)pyridine-2-carboxamide
CID 62159814
6-amino-N-butan-2-yl-3-chloro-N-ethylpyridine-2-carboxamide
CID 62154764
6-amino-3-chloro-N-[4-(furan-2-yl)butan-2-yl]pyridine-2-carboxamide
CID 62185489

Frequently Asked Questions

What is the IUPAC name of 6-amino-3-chloro-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide?
The IUPAC name of 6-amino-3-chloro-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide (CID 55257710) is 6-amino-3-chloro-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for 6-amino-3-chloro-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide?
The canonical SMILES for 6-amino-3-chloro-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide is CCC(CC)C(C)NC(=O)c1nc(N)ccc1Cl.
What is the InChIKey of 6-amino-3-chloro-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide?
The InChIKey is QQNUWPDFFJDMNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20ClN3O/c1-4-9(5-2)8(3)16-13(18)12-10(14)6-7-11(15)17-12/h6-9H,4-5H2,1-3H3,(H2,15,17)(H,16,18).
What are the key properties of 6-amino-3-chloro-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide?
6-amino-3-chloro-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide has a molecular weight of 269.78 g/mol, XLogP of 2.87, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-3-chloro-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 55257710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).