N-cyclohexyl-6-[(2,6-dichlorophenoxy)methyl]pyridine-2-carboxamide

C19H20Cl2N2O2 — CID 58211063

IUPACN-cyclohexyl-6-[(2,6-dichlorophenoxy)methyl]pyridine-2-carboxamide
SMILESO=C(NC1CCCCC1)c1cccc(COc2c(Cl)cccc2Cl)n1
InChIInChI=1S/C19H20Cl2N2O2/c20-15-9-5-10-16(21)18(15)25-12-14-8-4-11-17(22-14)19(24)23-13-6-2-1-3-7-13/h4-5,8-11,13H,1-3,6-7,12H2,(H,23,24)
InChIKeyPCGVOTAUDCJNQA-UHFFFAOYSA-N
MW379.29 g/mol
LogP5.03
Rot. Bonds5

About N-cyclohexyl-6-[(2,6-dichlorophenoxy)methyl]pyridine-2-carboxamide

N-cyclohexyl-6-[(2,6-dichlorophenoxy)methyl]pyridine-2-carboxamide (PubChem CID 58211063) has the molecular formula C19H20Cl2N2O2 and a molecular weight of 379.29 g/mol. Its IUPAC name is N-cyclohexyl-6-[(2,6-dichlorophenoxy)methyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-6-[(2,6-dichlorophenoxy)methyl]pyridine-2-carboxamide
PubChem CID58211063
Molecular FormulaC19H20Cl2N2O2
Molecular Weight379.29 g/mol
Exact Mass378.09
IUPAC NameN-cyclohexyl-6-[(2,6-dichlorophenoxy)methyl]pyridine-2-carboxamide
SMILESO=C(NC1CCCCC1)c1cccc(COc2c(Cl)cccc2Cl)n1
InChIInChI=1S/C19H20Cl2N2O2/c20-15-9-5-10-16(21)18(15)25-12-14-8-4-11-17(22-14)19(24)23-13-6-2-1-3-7-13/h4-5,8-11,13H,1-3,6-7,12H2,(H,23,24)
InChIKeyPCGVOTAUDCJNQA-UHFFFAOYSA-N
XLogP5.03
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500379.29
LogP ≤ 55.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-[(2-chloro-4-methylphenoxy)methyl]-N-cyclohexylpyridine-2-carboxamide
CID 58210807
2-N-cycloheptyl-6-N-cyclohexylpyridine-2,6-dicarboxamide
CID 109095319
6-(2-chlorophenyl)-N-cyclohexylpyridine-2-carboxamide
CID 58210870
N-cyclohexyl-6-[(2,4-dimethylphenoxy)methyl]pyridine-2-carboxamide
CID 58210525
2-N-cycloheptyl-6-N-cyclopropylpyridine-2,6-dicarboxamide
CID 109093881
6-[(2-chloro-6-methylphenyl)sulfanylmethyl]-N-cyclohexylpyridine-2-carboxamide
CID 11988639
N-cyclohexyl-1-[(2,6-dichlorophenoxy)methyl]pyrazole-3-carboxamide
CID 4867173
6-chloro-N-cyclobutylpyridine-2-carboxamide
CID 62416543
azepan-1-yl-[6-[(2,4,6-trichlorophenoxy)methyl]-2-pyridinyl]methanone
CID 58211391
(2,6-dichlorophenyl) N-cyclohexylcarbamate
CID 134113156
N-cyclopentyl-6-(piperidine-1-carbonyl)pyridine-2-carboxamide
CID 109094934
6-(azepan-1-yl)-N-cycloheptylpyridine-2-carboxamide
CID 84573847

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-6-[(2,6-dichlorophenoxy)methyl]pyridine-2-carboxamide?
The IUPAC name of N-cyclohexyl-6-[(2,6-dichlorophenoxy)methyl]pyridine-2-carboxamide (CID 58211063) is N-cyclohexyl-6-[(2,6-dichlorophenoxy)methyl]pyridine-2-carboxamide.
What is the SMILES notation for N-cyclohexyl-6-[(2,6-dichlorophenoxy)methyl]pyridine-2-carboxamide?
The canonical SMILES for N-cyclohexyl-6-[(2,6-dichlorophenoxy)methyl]pyridine-2-carboxamide is O=C(NC1CCCCC1)c1cccc(COc2c(Cl)cccc2Cl)n1.
What is the InChIKey of N-cyclohexyl-6-[(2,6-dichlorophenoxy)methyl]pyridine-2-carboxamide?
The InChIKey is PCGVOTAUDCJNQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20Cl2N2O2/c20-15-9-5-10-16(21)18(15)25-12-14-8-4-11-17(22-14)19(24)23-13-6-2-1-3-7-13/h4-5,8-11,13H,1-3,6-7,12H2,(H,23,24).
What are the key properties of N-cyclohexyl-6-[(2,6-dichlorophenoxy)methyl]pyridine-2-carboxamide?
N-cyclohexyl-6-[(2,6-dichlorophenoxy)methyl]pyridine-2-carboxamide has a molecular weight of 379.29 g/mol, XLogP of 5.03, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-6-[(2,6-dichlorophenoxy)methyl]pyridine-2-carboxamide is sourced from PubChem (CID 58211063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).