2-(2-chlorophenoxy)-N-cyclohexylpyridine-3-carboxamide

C18H19ClN2O2 — CID 56661736

IUPAC2-(2-chlorophenoxy)-N-cyclohexylpyridine-3-carboxamide
SMILESO=C(NC1CCCCC1)c1cccnc1Oc1ccccc1Cl
InChIInChI=1S/C18H19ClN2O2/c19-15-10-4-5-11-16(15)23-18-14(9-6-12-20-18)17(22)21-13-7-2-1-3-8-13/h4-6,9-13H,1-3,7-8H2,(H,21,22)
InChIKeyOTRPLLCDMZYHHI-UHFFFAOYSA-N
MW330.81 g/mol
LogP4.59
Rot. Bonds4

About 2-(2-chlorophenoxy)-N-cyclohexylpyridine-3-carboxamide

2-(2-chlorophenoxy)-N-cyclohexylpyridine-3-carboxamide (PubChem CID 56661736) has the molecular formula C18H19ClN2O2 and a molecular weight of 330.81 g/mol. Its IUPAC name is 2-(2-chlorophenoxy)-N-cyclohexylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-(2-chlorophenoxy)-N-cyclohexylpyridine-3-carboxamide
PubChem CID56661736
Molecular FormulaC18H19ClN2O2
Molecular Weight330.81 g/mol
Exact Mass330.11
IUPAC Name2-(2-chlorophenoxy)-N-cyclohexylpyridine-3-carboxamide
SMILESO=C(NC1CCCCC1)c1cccnc1Oc1ccccc1Cl
InChIInChI=1S/C18H19ClN2O2/c19-15-10-4-5-11-16(15)23-18-14(9-6-12-20-18)17(22)21-13-7-2-1-3-8-13/h4-6,9-13H,1-3,7-8H2,(H,21,22)
InChIKeyOTRPLLCDMZYHHI-UHFFFAOYSA-N
XLogP4.59
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.81
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-cyclopentylbenzamide
CID 669043
N-cyclohexyl-2-methylpyridine-3-carboxamide
CID 78951017
2-(2,4-dichlorophenoxy)-N-(2-methylpiperidin-4-yl)pyridine-3-carboxamide;dihydrochloride
CID 120601228
methyl 4-[(2-methoxypyridine-3-carbonyl)amino]cyclohexane-1-carboxylate
CID 115617208
2-chloro-N-cycloheptylbenzamide;pyrrolidine
CID 143233402
4-[[2-(4-fluorophenoxy)pyridine-3-carbonyl]amino]cyclohexane-1-carboxylic acid
CID 22058409
5-chloro-N-cyclohexylquinoline-8-carboxamide
CID 37248042
N-cyclohexyl-2-(propan-2-ylamino)pyridine-3-carboxamide
CID 44761338
2-[4-(benzenesulfonamido)phenoxy]-N-cyclopropylpyridine-3-carboxamide
CID 53120215
2-chloro-N-(4-methylcycloheptyl)pyridine-3-carboxamide
CID 102796878
2-[4-[(4-acetamidophenyl)sulfonylamino]phenoxy]-N-cyclopentylpyridine-3-carboxamide
CID 53120219
2-(2-bromophenoxy)-N-[4-[[4-(dimethylamino)-5-methylpyrimidin-2-yl]amino]cyclohexyl]pyridine-3-carboxamide
CID 23026734

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenoxy)-N-cyclohexylpyridine-3-carboxamide?
The IUPAC name of 2-(2-chlorophenoxy)-N-cyclohexylpyridine-3-carboxamide (CID 56661736) is 2-(2-chlorophenoxy)-N-cyclohexylpyridine-3-carboxamide.
What is the SMILES notation for 2-(2-chlorophenoxy)-N-cyclohexylpyridine-3-carboxamide?
The canonical SMILES for 2-(2-chlorophenoxy)-N-cyclohexylpyridine-3-carboxamide is O=C(NC1CCCCC1)c1cccnc1Oc1ccccc1Cl.
What is the InChIKey of 2-(2-chlorophenoxy)-N-cyclohexylpyridine-3-carboxamide?
The InChIKey is OTRPLLCDMZYHHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClN2O2/c19-15-10-4-5-11-16(15)23-18-14(9-6-12-20-18)17(22)21-13-7-2-1-3-8-13/h4-6,9-13H,1-3,7-8H2,(H,21,22).
What are the key properties of 2-(2-chlorophenoxy)-N-cyclohexylpyridine-3-carboxamide?
2-(2-chlorophenoxy)-N-cyclohexylpyridine-3-carboxamide has a molecular weight of 330.81 g/mol, XLogP of 4.59, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenoxy)-N-cyclohexylpyridine-3-carboxamide is sourced from PubChem (CID 56661736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).