N-(6-chloro-5-methyl-3-pyridinyl)-2-cyclohexylacetamide

C14H19ClN2O — CID 103730501

IUPACN-(6-chloro-5-methyl-3-pyridinyl)-2-cyclohexylacetamide
SMILESCc1cc(NC(=O)CC2CCCCC2)cnc1Cl
InChIInChI=1S/C14H19ClN2O/c1-10-7-12(9-16-14(10)15)17-13(18)8-11-5-3-2-4-6-11/h7,9,11H,2-6,8H2,1H3,(H,17,18)
InChIKeyDEHXUGVNHLFSFS-UHFFFAOYSA-N
MW266.77 g/mol
LogP3.95
Rot. Bonds3

About N-(6-chloro-5-methyl-3-pyridinyl)-2-cyclohexylacetamide

N-(6-chloro-5-methyl-3-pyridinyl)-2-cyclohexylacetamide (PubChem CID 103730501) has the molecular formula C14H19ClN2O and a molecular weight of 266.77 g/mol. Its IUPAC name is N-(6-chloro-5-methyl-3-pyridinyl)-2-cyclohexylacetamide.

Molecular Properties

Compound NameN-(6-chloro-5-methyl-3-pyridinyl)-2-cyclohexylacetamide
PubChem CID103730501
Molecular FormulaC14H19ClN2O
Molecular Weight266.77 g/mol
Exact Mass266.12
IUPAC NameN-(6-chloro-5-methyl-3-pyridinyl)-2-cyclohexylacetamide
SMILESCc1cc(NC(=O)CC2CCCCC2)cnc1Cl
InChIInChI=1S/C14H19ClN2O/c1-10-7-12(9-16-14(10)15)17-13(18)8-11-5-3-2-4-6-11/h7,9,11H,2-6,8H2,1H3,(H,17,18)
InChIKeyDEHXUGVNHLFSFS-UHFFFAOYSA-N
XLogP3.95
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.77
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(6-chloro-5-methyl-3-pyridinyl)-3-cyclopentylpropanamide
CID 103730306
N-(6-chloro-5-methyl-3-pyridinyl)-2-cyclopent-2-en-1-ylacetamide
CID 103730318
N-(6-chloro-5-methyl-3-pyridinyl)cyclopentanecarboxamide
CID 103730413
N-(6-chloro-5-methyl-3-pyridinyl)cyclobutanecarboxamide
CID 103730424
N-(6-chloro-3-pyridinyl)-2-cyclopentylacetamide
CID 54788342
N-(6-chloro-5-methyl-3-pyridinyl)-3,3-dimethylbutanamide
CID 103730445
N-(6-chloro-5-methyl-3-pyridinyl)-1,3,3a,4,5,6,7,7a-octahydroisoindole-2-carboxamide
CID 146089895
2-cyclopentyl-N-[2-(3,5-dimethylpyrazol-1-yl)pyrimidin-5-yl]acetamide
CID 122300441
2-cyclohexyl-N-[6-(methylamino)-3-pyridinyl]acetamide
CID 115274700
N-(4-bromo-3-methylphenyl)-2-cyclopentylacetamide
CID 2679466
N-(6-chloro-5-methyl-3-pyridinyl)-1,1-dioxothiane-2-carboxamide
CID 104537088
N-(6-chloro-5-methyl-3-pyridinyl)pent-4-enamide
CID 103730487

Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-5-methyl-3-pyridinyl)-2-cyclohexylacetamide?
The IUPAC name of N-(6-chloro-5-methyl-3-pyridinyl)-2-cyclohexylacetamide (CID 103730501) is N-(6-chloro-5-methyl-3-pyridinyl)-2-cyclohexylacetamide.
What is the SMILES notation for N-(6-chloro-5-methyl-3-pyridinyl)-2-cyclohexylacetamide?
The canonical SMILES for N-(6-chloro-5-methyl-3-pyridinyl)-2-cyclohexylacetamide is Cc1cc(NC(=O)CC2CCCCC2)cnc1Cl.
What is the InChIKey of N-(6-chloro-5-methyl-3-pyridinyl)-2-cyclohexylacetamide?
The InChIKey is DEHXUGVNHLFSFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O/c1-10-7-12(9-16-14(10)15)17-13(18)8-11-5-3-2-4-6-11/h7,9,11H,2-6,8H2,1H3,(H,17,18).
What are the key properties of N-(6-chloro-5-methyl-3-pyridinyl)-2-cyclohexylacetamide?
N-(6-chloro-5-methyl-3-pyridinyl)-2-cyclohexylacetamide has a molecular weight of 266.77 g/mol, XLogP of 3.95, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloro-5-methyl-3-pyridinyl)-2-cyclohexylacetamide is sourced from PubChem (CID 103730501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).