5-chloro-N-cyclohexyl-2-(1,1-difluoroethyl)pyridine-3-carboxamide

C14H17ClF2N2O — CID 167055905

IUPAC5-chloro-N-cyclohexyl-2-(1,1-difluoroethyl)pyridine-3-carboxamide
SMILESCC(F)(F)c1ncc(Cl)cc1C(=O)NC1CCCCC1
InChIInChI=1S/C14H17ClF2N2O/c1-14(16,17)12-11(7-9(15)8-18-12)13(20)19-10-5-3-2-4-6-10/h7-8,10H,2-6H2,1H3,(H,19,20)
InChIKeyQGKBNYNDYMCAAT-UHFFFAOYSA-N
MW302.75 g/mol
LogP3.91
Rot. Bonds3

About 5-chloro-N-cyclohexyl-2-(1,1-difluoroethyl)pyridine-3-carboxamide

5-chloro-N-cyclohexyl-2-(1,1-difluoroethyl)pyridine-3-carboxamide (PubChem CID 167055905) has the molecular formula C14H17ClF2N2O and a molecular weight of 302.75 g/mol. Its IUPAC name is 5-chloro-N-cyclohexyl-2-(1,1-difluoroethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-N-cyclohexyl-2-(1,1-difluoroethyl)pyridine-3-carboxamide
PubChem CID167055905
Molecular FormulaC14H17ClF2N2O
Molecular Weight302.75 g/mol
Exact Mass302.10
IUPAC Name5-chloro-N-cyclohexyl-2-(1,1-difluoroethyl)pyridine-3-carboxamide
SMILESCC(F)(F)c1ncc(Cl)cc1C(=O)NC1CCCCC1
InChIInChI=1S/C14H17ClF2N2O/c1-14(16,17)12-11(7-9(15)8-18-12)13(20)19-10-5-3-2-4-6-10/h7-8,10H,2-6H2,1H3,(H,19,20)
InChIKeyQGKBNYNDYMCAAT-UHFFFAOYSA-N
XLogP3.91
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.75
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-N-cyclohexyl-2-(difluoromethyl)pyridine-3-carboxamide
CID 166988492
5-chloro-N-cyclohexyl-2-methylbenzamide
CID 83407385
5-chloro-N-cycloheptyl-2-fluorobenzamide
CID 9082182
2-chloro-N-cyclohexyl-5-(2-fluoropropan-2-yl)benzamide
CID 167056111
5-chloro-N-cyclohexyl-2-(ethylamino)pyridine-4-carboxamide
CID 114921677
4,5-dichloro-1-N,2-N-dicyclohexylbenzene-1,2-dicarboxamide
CID 23880547
5-chloro-N-cyclohexyl-2-oxo-1H-pyridine-3-carboxamide
CID 110848953
4-chloro-N-cycloheptyl-2-fluorobenzamide
CID 26002204
3,5-dichloro-N-cyclopentadecyl-2-hydroxybenzamide
CID 72547632
N-cyclohexyl-4-(1,1-difluoroethyl)-2-(3,4-dihydroxyanilino)pyrimidine-5-carboxamide
CID 162552368
2,5-dichloro-3-(cyclohexylcarbamoyl)benzenesulfonyl chloride
CID 65367156
tert-butyl carbamate;2-chloro-N-cyclohexyl-5-fluoropyridine-3-carboxamide
CID 174473479

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-cyclohexyl-2-(1,1-difluoroethyl)pyridine-3-carboxamide?
The IUPAC name of 5-chloro-N-cyclohexyl-2-(1,1-difluoroethyl)pyridine-3-carboxamide (CID 167055905) is 5-chloro-N-cyclohexyl-2-(1,1-difluoroethyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-N-cyclohexyl-2-(1,1-difluoroethyl)pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-N-cyclohexyl-2-(1,1-difluoroethyl)pyridine-3-carboxamide is CC(F)(F)c1ncc(Cl)cc1C(=O)NC1CCCCC1.
What is the InChIKey of 5-chloro-N-cyclohexyl-2-(1,1-difluoroethyl)pyridine-3-carboxamide?
The InChIKey is QGKBNYNDYMCAAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClF2N2O/c1-14(16,17)12-11(7-9(15)8-18-12)13(20)19-10-5-3-2-4-6-10/h7-8,10H,2-6H2,1H3,(H,19,20).
What are the key properties of 5-chloro-N-cyclohexyl-2-(1,1-difluoroethyl)pyridine-3-carboxamide?
5-chloro-N-cyclohexyl-2-(1,1-difluoroethyl)pyridine-3-carboxamide has a molecular weight of 302.75 g/mol, XLogP of 3.91, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-cyclohexyl-2-(1,1-difluoroethyl)pyridine-3-carboxamide is sourced from PubChem (CID 167055905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).