N-(6-chloro-5-methyl-3-pyridinyl)cyclopentanecarboxamide

C12H15ClN2O — CID 103730413

IUPACN-(6-chloro-5-methyl-3-pyridinyl)cyclopentanecarboxamide
SMILESCc1cc(NC(=O)C2CCCC2)cnc1Cl
InChIInChI=1S/C12H15ClN2O/c1-8-6-10(7-14-11(8)13)15-12(16)9-4-2-3-5-9/h6-7,9H,2-5H2,1H3,(H,15,16)
InChIKeyRKTLXAYEBXDMNX-UHFFFAOYSA-N
MW238.72 g/mol
LogP3.17
Rot. Bonds2

About N-(6-chloro-5-methyl-3-pyridinyl)cyclopentanecarboxamide

N-(6-chloro-5-methyl-3-pyridinyl)cyclopentanecarboxamide (PubChem CID 103730413) has the molecular formula C12H15ClN2O and a molecular weight of 238.72 g/mol. Its IUPAC name is N-(6-chloro-5-methyl-3-pyridinyl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(6-chloro-5-methyl-3-pyridinyl)cyclopentanecarboxamide
PubChem CID103730413
Molecular FormulaC12H15ClN2O
Molecular Weight238.72 g/mol
Exact Mass238.09
IUPAC NameN-(6-chloro-5-methyl-3-pyridinyl)cyclopentanecarboxamide
SMILESCc1cc(NC(=O)C2CCCC2)cnc1Cl
InChIInChI=1S/C12H15ClN2O/c1-8-6-10(7-14-11(8)13)15-12(16)9-4-2-3-5-9/h6-7,9H,2-5H2,1H3,(H,15,16)
InChIKeyRKTLXAYEBXDMNX-UHFFFAOYSA-N
XLogP3.17
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.72
LogP ≤ 53.17
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)cyclobutanecarboxamide
CID 103730424
N-(6-chloro-5-methyl-3-pyridinyl)-1,1-dioxothiane-2-carboxamide
CID 104537088
N-(6-chloro-5-methyl-3-pyridinyl)thiolane-2-carboxamide
CID 103745323
N-(6-chloro-5-methyl-3-pyridinyl)-2-cyclohexylacetamide
CID 103730501
N-(6-chloro-5-methyl-3-pyridinyl)-3-cyclopentylpropanamide
CID 103730306
N-(6-chloro-5-methyl-3-pyridinyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide
CID 103796996
N-(6-chloro-5-methyl-3-pyridinyl)-1,3,3a,4,5,6,7,7a-octahydroisoindole-2-carboxamide
CID 146089895
N-(5-bromo-6-chloro-3-pyridinyl)cyclopropanecarboxamide
CID 103816457
N-(5-chloro-6-methyl-3-pyridinyl)oxepane-4-carboxamide
CID 154871816
6-chloro-N-cyclooctyl-5-methylpyridin-3-amine
CID 114049267
N-(6-chloro-5-methyl-3-pyridinyl)adamantane-1-carboxamide
CID 103730509
N-(6-chloro-5-methyl-3-pyridinyl)cyclohexanesulfonamide
CID 103744873

Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-5-methyl-3-pyridinyl)cyclopentanecarboxamide?
The IUPAC name of N-(6-chloro-5-methyl-3-pyridinyl)cyclopentanecarboxamide (CID 103730413) is N-(6-chloro-5-methyl-3-pyridinyl)cyclopentanecarboxamide.
What is the SMILES notation for N-(6-chloro-5-methyl-3-pyridinyl)cyclopentanecarboxamide?
The canonical SMILES for N-(6-chloro-5-methyl-3-pyridinyl)cyclopentanecarboxamide is Cc1cc(NC(=O)C2CCCC2)cnc1Cl.
What is the InChIKey of N-(6-chloro-5-methyl-3-pyridinyl)cyclopentanecarboxamide?
The InChIKey is RKTLXAYEBXDMNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClN2O/c1-8-6-10(7-14-11(8)13)15-12(16)9-4-2-3-5-9/h6-7,9H,2-5H2,1H3,(H,15,16).
What are the key properties of N-(6-chloro-5-methyl-3-pyridinyl)cyclopentanecarboxamide?
N-(6-chloro-5-methyl-3-pyridinyl)cyclopentanecarboxamide has a molecular weight of 238.72 g/mol, XLogP of 3.17, 2 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)cyclopentanecarboxamide is sourced from PubChem (CID 103730413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).