N-[3-(2-methylpiperidin-1-yl)propyl]benzamide

C16H24N2O — CID 60668475

IUPACN-[3-(2-methylpiperidin-1-yl)propyl]benzamide
SMILESCC1CCCCN1CCCNC(=O)c1ccccc1
InChIInChI=1S/C16H24N2O/c1-14-8-5-6-12-18(14)13-7-11-17-16(19)15-9-3-2-4-10-15/h2-4,9-10,14H,5-8,11-13H2,1H3,(H,17,19)
InChIKeySNEKOAVNZBLNAF-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.68
Rot. Bonds5

About N-[3-(2-methylpiperidin-1-yl)propyl]benzamide

N-[3-(2-methylpiperidin-1-yl)propyl]benzamide (PubChem CID 60668475) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-[3-(2-methylpiperidin-1-yl)propyl]benzamide.

Molecular Properties

Compound NameN-[3-(2-methylpiperidin-1-yl)propyl]benzamide
PubChem CID60668475
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-[3-(2-methylpiperidin-1-yl)propyl]benzamide
SMILESCC1CCCCN1CCCNC(=O)c1ccccc1
InChIInChI=1S/C16H24N2O/c1-14-8-5-6-12-18(14)13-7-11-17-16(19)15-9-3-2-4-10-15/h2-4,9-10,14H,5-8,11-13H2,1H3,(H,17,19)
InChIKeySNEKOAVNZBLNAF-UHFFFAOYSA-N
XLogP2.68
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-[3-(2-methylpiperidin-1-yl)propylamino]-2-oxoethyl]benzamide
CID 85018800
4-amino-N-[3-[(2R)-2-methylpiperidin-1-yl]propyl]benzamide
CID 38989093
4-bromo-N-[3-[(2R)-2-methylpiperidin-1-yl]propyl]benzamide
CID 7998756
N-[3-[(2R)-2-methylpiperidin-1-yl]propyl]-4-methylsulfanylbenzamide
CID 9473480
N-[3-[(2S)-2-methylpiperidin-1-yl]propyl]-4-methylsulfonylbenzamide
CID 9473048
N-[4-(2-methylpiperidin-1-yl)butyl]naphthalene-2-carboxamide
CID 51115795
4-cyano-N-[3-[(2R)-2-methylpiperidin-1-yl]propyl]benzamide
CID 9472549
4-cyano-N-[3-[(2S)-2-methylpiperidin-1-yl]propyl]benzamide
CID 9472553
N-[3-[(2S)-2-methylpiperidin-1-yl]propyl]-4-pyrazol-1-ylbenzamide
CID 9473184
methyl 3-[4-(2-methylpiperidin-1-yl)butylcarbamoyl]benzoate
CID 60516453
3-(methanesulfonamido)-N-[3-(2-methylpiperidin-1-yl)propyl]benzamide
CID 51221498
3,4-dichloro-N-[3-[(2S)-2-methylpiperidin-1-yl]propyl]benzamide
CID 9473209

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-methylpiperidin-1-yl)propyl]benzamide?
The IUPAC name of N-[3-(2-methylpiperidin-1-yl)propyl]benzamide (CID 60668475) is N-[3-(2-methylpiperidin-1-yl)propyl]benzamide.
What is the SMILES notation for N-[3-(2-methylpiperidin-1-yl)propyl]benzamide?
The canonical SMILES for N-[3-(2-methylpiperidin-1-yl)propyl]benzamide is CC1CCCCN1CCCNC(=O)c1ccccc1.
What is the InChIKey of N-[3-(2-methylpiperidin-1-yl)propyl]benzamide?
The InChIKey is SNEKOAVNZBLNAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-14-8-5-6-12-18(14)13-7-11-17-16(19)15-9-3-2-4-10-15/h2-4,9-10,14H,5-8,11-13H2,1H3,(H,17,19).
What are the key properties of N-[3-(2-methylpiperidin-1-yl)propyl]benzamide?
N-[3-(2-methylpiperidin-1-yl)propyl]benzamide has a molecular weight of 260.38 g/mol, XLogP of 2.68, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-methylpiperidin-1-yl)propyl]benzamide is sourced from PubChem (CID 60668475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).