2-amino-6-chloro-N-(1-cyclohexylethyl)pyridine-4-carboxamide

C14H20ClN3O — CID 62407259

IUPAC2-amino-6-chloro-N-(1-cyclohexylethyl)pyridine-4-carboxamide
SMILESCC(NC(=O)c1cc(N)nc(Cl)c1)C1CCCCC1
InChIInChI=1S/C14H20ClN3O/c1-9(10-5-3-2-4-6-10)17-14(19)11-7-12(15)18-13(16)8-11/h7-10H,2-6H2,1H3,(H2,16,18)(H,17,19)
InChIKeyDQIGMHJOUOAXMJ-UHFFFAOYSA-N
MW281.79 g/mol
LogP3.02
Rot. Bonds3

About 2-amino-6-chloro-N-(1-cyclohexylethyl)pyridine-4-carboxamide

2-amino-6-chloro-N-(1-cyclohexylethyl)pyridine-4-carboxamide (PubChem CID 62407259) has the molecular formula C14H20ClN3O and a molecular weight of 281.79 g/mol. Its IUPAC name is 2-amino-6-chloro-N-(1-cyclohexylethyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-6-chloro-N-(1-cyclohexylethyl)pyridine-4-carboxamide
PubChem CID62407259
Molecular FormulaC14H20ClN3O
Molecular Weight281.79 g/mol
Exact Mass281.13
IUPAC Name2-amino-6-chloro-N-(1-cyclohexylethyl)pyridine-4-carboxamide
SMILESCC(NC(=O)c1cc(N)nc(Cl)c1)C1CCCCC1
InChIInChI=1S/C14H20ClN3O/c1-9(10-5-3-2-4-6-10)17-14(19)11-7-12(15)18-13(16)8-11/h7-10H,2-6H2,1H3,(H2,16,18)(H,17,19)
InChIKeyDQIGMHJOUOAXMJ-UHFFFAOYSA-N
XLogP3.02
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.79
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

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CID 81392061
2-amino-N-butan-2-yl-6-chloropyridine-4-carboxamide
CID 62155359
3-chloro-N-(1-cyclohexylethyl)-4-hydroxybenzamide
CID 62407060
4-amino-3-chloro-N-[(1S)-1-cyclopentylethyl]benzamide
CID 81388850
N-(1-cyclohexylethyl)-3,4,5-trifluorobenzamide
CID 63189611
6-chloro-N-(1-cyclohexylethyl)pyrazine-2-carboxamide
CID 106551401
3-amino-N-(1-cyclohexylethyl)benzamide
CID 62404995
3,5-diamino-N-(1-cyclopropylethyl)benzamide
CID 61094229
6-amino-N-(1-cyclohexylethyl)pyrazine-2-carboxamide
CID 114035892
4-amino-N-(1-cyclopentylethyl)benzamide;hydrochloride
CID 119782446
3-amino-N-(1-cyclopentylethyl)-1H-pyrazole-5-carboxamide
CID 64523510
N-[(1S)-1-cyclohexylethyl]-4-[4-[[(1S)-1-cyclohexylethyl]carbamoyl]phenyl]benzamide
CID 132596984

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-chloro-N-(1-cyclohexylethyl)pyridine-4-carboxamide?
The IUPAC name of 2-amino-6-chloro-N-(1-cyclohexylethyl)pyridine-4-carboxamide (CID 62407259) is 2-amino-6-chloro-N-(1-cyclohexylethyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-6-chloro-N-(1-cyclohexylethyl)pyridine-4-carboxamide?
The canonical SMILES for 2-amino-6-chloro-N-(1-cyclohexylethyl)pyridine-4-carboxamide is CC(NC(=O)c1cc(N)nc(Cl)c1)C1CCCCC1.
What is the InChIKey of 2-amino-6-chloro-N-(1-cyclohexylethyl)pyridine-4-carboxamide?
The InChIKey is DQIGMHJOUOAXMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClN3O/c1-9(10-5-3-2-4-6-10)17-14(19)11-7-12(15)18-13(16)8-11/h7-10H,2-6H2,1H3,(H2,16,18)(H,17,19).
What are the key properties of 2-amino-6-chloro-N-(1-cyclohexylethyl)pyridine-4-carboxamide?
2-amino-6-chloro-N-(1-cyclohexylethyl)pyridine-4-carboxamide has a molecular weight of 281.79 g/mol, XLogP of 3.02, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-chloro-N-(1-cyclohexylethyl)pyridine-4-carboxamide is sourced from PubChem (CID 62407259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).