3-cyclopentyl-N-[(2-methoxy-4-pyridinyl)methyl]propanamide

C15H22N2O2 — CID 86919796

IUPAC3-cyclopentyl-N-[(2-methoxy-4-pyridinyl)methyl]propanamide
SMILESCOc1cc(CNC(=O)CCC2CCCC2)ccn1
InChIInChI=1S/C15H22N2O2/c1-19-15-10-13(8-9-16-15)11-17-14(18)7-6-12-4-2-3-5-12/h8-10,12H,2-7,11H2,1H3,(H,17,18)
InChIKeyCOSHIQAGNHARTI-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.68
Rot. Bonds6

About 3-cyclopentyl-N-[(2-methoxy-4-pyridinyl)methyl]propanamide

3-cyclopentyl-N-[(2-methoxy-4-pyridinyl)methyl]propanamide (PubChem CID 86919796) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 3-cyclopentyl-N-[(2-methoxy-4-pyridinyl)methyl]propanamide.

Molecular Properties

Compound Name3-cyclopentyl-N-[(2-methoxy-4-pyridinyl)methyl]propanamide
PubChem CID86919796
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name3-cyclopentyl-N-[(2-methoxy-4-pyridinyl)methyl]propanamide
SMILESCOc1cc(CNC(=O)CCC2CCCC2)ccn1
InChIInChI=1S/C15H22N2O2/c1-19-15-10-13(8-9-16-15)11-17-14(18)7-6-12-4-2-3-5-12/h8-10,12H,2-7,11H2,1H3,(H,17,18)
InChIKeyCOSHIQAGNHARTI-UHFFFAOYSA-N
XLogP2.68
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-[(2-methoxy-4-pyridinyl)methyl]propanamide?
The IUPAC name of 3-cyclopentyl-N-[(2-methoxy-4-pyridinyl)methyl]propanamide (CID 86919796) is 3-cyclopentyl-N-[(2-methoxy-4-pyridinyl)methyl]propanamide.
What is the SMILES notation for 3-cyclopentyl-N-[(2-methoxy-4-pyridinyl)methyl]propanamide?
The canonical SMILES for 3-cyclopentyl-N-[(2-methoxy-4-pyridinyl)methyl]propanamide is COc1cc(CNC(=O)CCC2CCCC2)ccn1.
What is the InChIKey of 3-cyclopentyl-N-[(2-methoxy-4-pyridinyl)methyl]propanamide?
The InChIKey is COSHIQAGNHARTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-19-15-10-13(8-9-16-15)11-17-14(18)7-6-12-4-2-3-5-12/h8-10,12H,2-7,11H2,1H3,(H,17,18).
What are the key properties of 3-cyclopentyl-N-[(2-methoxy-4-pyridinyl)methyl]propanamide?
3-cyclopentyl-N-[(2-methoxy-4-pyridinyl)methyl]propanamide has a molecular weight of 262.35 g/mol, XLogP of 2.68, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-[(2-methoxy-4-pyridinyl)methyl]propanamide is sourced from PubChem (CID 86919796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).