2-methyl-N-[3-(2-methylpiperidine-1-carbonyl)phenyl]propanamide

C17H24N2O2 — CID 2938674

IUPAC2-methyl-N-[3-(2-methylpiperidine-1-carbonyl)phenyl]propanamide
SMILESCC(C)C(=O)Nc1cccc(C(=O)N2CCCCC2C)c1
InChIInChI=1S/C17H24N2O2/c1-12(2)16(20)18-15-9-6-8-14(11-15)17(21)19-10-5-4-7-13(19)3/h6,8-9,11-13H,4-5,7,10H2,1-3H3,(H,18,20)
InChIKeyRYOKIJKDWWZWGL-UHFFFAOYSA-N
MW288.39 g/mol
LogP3.30
Rot. Bonds3

About 2-methyl-N-[3-(2-methylpiperidine-1-carbonyl)phenyl]propanamide

2-methyl-N-[3-(2-methylpiperidine-1-carbonyl)phenyl]propanamide (PubChem CID 2938674) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 2-methyl-N-[3-(2-methylpiperidine-1-carbonyl)phenyl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[3-(2-methylpiperidine-1-carbonyl)phenyl]propanamide
PubChem CID2938674
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name2-methyl-N-[3-(2-methylpiperidine-1-carbonyl)phenyl]propanamide
SMILESCC(C)C(=O)Nc1cccc(C(=O)N2CCCCC2C)c1
InChIInChI=1S/C17H24N2O2/c1-12(2)16(20)18-15-9-6-8-14(11-15)17(21)19-10-5-4-7-13(19)3/h6,8-9,11-13H,4-5,7,10H2,1-3H3,(H,18,20)
InChIKeyRYOKIJKDWWZWGL-UHFFFAOYSA-N
XLogP3.30
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[3-(2-methylpiperidine-1-carbonyl)phenyl]propanamide?
The IUPAC name of 2-methyl-N-[3-(2-methylpiperidine-1-carbonyl)phenyl]propanamide (CID 2938674) is 2-methyl-N-[3-(2-methylpiperidine-1-carbonyl)phenyl]propanamide.
What is the SMILES notation for 2-methyl-N-[3-(2-methylpiperidine-1-carbonyl)phenyl]propanamide?
The canonical SMILES for 2-methyl-N-[3-(2-methylpiperidine-1-carbonyl)phenyl]propanamide is CC(C)C(=O)Nc1cccc(C(=O)N2CCCCC2C)c1.
What is the InChIKey of 2-methyl-N-[3-(2-methylpiperidine-1-carbonyl)phenyl]propanamide?
The InChIKey is RYOKIJKDWWZWGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-12(2)16(20)18-15-9-6-8-14(11-15)17(21)19-10-5-4-7-13(19)3/h6,8-9,11-13H,4-5,7,10H2,1-3H3,(H,18,20).
What are the key properties of 2-methyl-N-[3-(2-methylpiperidine-1-carbonyl)phenyl]propanamide?
2-methyl-N-[3-(2-methylpiperidine-1-carbonyl)phenyl]propanamide has a molecular weight of 288.39 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[3-(2-methylpiperidine-1-carbonyl)phenyl]propanamide is sourced from PubChem (CID 2938674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).