3-cyclopentyl-N-(4,6-dimethyl-2-pyridinyl)propanamide

C15H22N2O — CID 4184818

IUPAC3-cyclopentyl-N-(4,6-dimethyl-2-pyridinyl)propanamide
SMILESCc1cc(C)nc(NC(=O)CCC2CCCC2)c1
InChIInChI=1S/C15H22N2O/c1-11-9-12(2)16-14(10-11)17-15(18)8-7-13-5-3-4-6-13/h9-10,13H,3-8H2,1-2H3,(H,16,17,18)
InChIKeyPMDQHGLZXZWLKR-UHFFFAOYSA-N
MW246.35 g/mol
LogP3.61
Rot. Bonds4

About 3-cyclopentyl-N-(4,6-dimethyl-2-pyridinyl)propanamide

3-cyclopentyl-N-(4,6-dimethyl-2-pyridinyl)propanamide (PubChem CID 4184818) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 3-cyclopentyl-N-(4,6-dimethyl-2-pyridinyl)propanamide.

Molecular Properties

Compound Name3-cyclopentyl-N-(4,6-dimethyl-2-pyridinyl)propanamide
PubChem CID4184818
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name3-cyclopentyl-N-(4,6-dimethyl-2-pyridinyl)propanamide
SMILESCc1cc(C)nc(NC(=O)CCC2CCCC2)c1
InChIInChI=1S/C15H22N2O/c1-11-9-12(2)16-14(10-11)17-15(18)8-7-13-5-3-4-6-13/h9-10,13H,3-8H2,1-2H3,(H,16,17,18)
InChIKeyPMDQHGLZXZWLKR-UHFFFAOYSA-N
XLogP3.61
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-(4,6-dimethyl-2-pyridinyl)propanamide?
The IUPAC name of 3-cyclopentyl-N-(4,6-dimethyl-2-pyridinyl)propanamide (CID 4184818) is 3-cyclopentyl-N-(4,6-dimethyl-2-pyridinyl)propanamide.
What is the SMILES notation for 3-cyclopentyl-N-(4,6-dimethyl-2-pyridinyl)propanamide?
The canonical SMILES for 3-cyclopentyl-N-(4,6-dimethyl-2-pyridinyl)propanamide is Cc1cc(C)nc(NC(=O)CCC2CCCC2)c1.
What is the InChIKey of 3-cyclopentyl-N-(4,6-dimethyl-2-pyridinyl)propanamide?
The InChIKey is PMDQHGLZXZWLKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-11-9-12(2)16-14(10-11)17-15(18)8-7-13-5-3-4-6-13/h9-10,13H,3-8H2,1-2H3,(H,16,17,18).
What are the key properties of 3-cyclopentyl-N-(4,6-dimethyl-2-pyridinyl)propanamide?
3-cyclopentyl-N-(4,6-dimethyl-2-pyridinyl)propanamide has a molecular weight of 246.35 g/mol, XLogP of 3.61, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-(4,6-dimethyl-2-pyridinyl)propanamide is sourced from PubChem (CID 4184818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).