N-(2-chlorophenyl)-3-(3-methylpiperidin-1-yl)propanamide

C15H21ClN2O — CID 3145302

IUPACN-(2-chlorophenyl)-3-(3-methylpiperidin-1-yl)propanamide
SMILESCC1CCCN(CCC(=O)Nc2ccccc2Cl)C1
InChIInChI=1S/C15H21ClN2O/c1-12-5-4-9-18(11-12)10-8-15(19)17-14-7-3-2-6-13(14)16/h2-3,6-7,12H,4-5,8-11H2,1H3,(H,17,19)
InChIKeyLJACRDNWPDYOBI-UHFFFAOYSA-N
MW280.80 g/mol
LogP3.40
Rot. Bonds4

About N-(2-chlorophenyl)-3-(3-methylpiperidin-1-yl)propanamide

N-(2-chlorophenyl)-3-(3-methylpiperidin-1-yl)propanamide (PubChem CID 3145302) has the molecular formula C15H21ClN2O and a molecular weight of 280.80 g/mol. Its IUPAC name is N-(2-chlorophenyl)-3-(3-methylpiperidin-1-yl)propanamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-3-(3-methylpiperidin-1-yl)propanamide
PubChem CID3145302
Molecular FormulaC15H21ClN2O
Molecular Weight280.80 g/mol
Exact Mass280.13
IUPAC NameN-(2-chlorophenyl)-3-(3-methylpiperidin-1-yl)propanamide
SMILESCC1CCCN(CCC(=O)Nc2ccccc2Cl)C1
InChIInChI=1S/C15H21ClN2O/c1-12-5-4-9-18(11-12)10-8-15(19)17-14-7-3-2-6-13(14)16/h2-3,6-7,12H,4-5,8-11H2,1H3,(H,17,19)
InChIKeyLJACRDNWPDYOBI-UHFFFAOYSA-N
XLogP3.40
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.80
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2-chlorophenyl)-3-(3-methylpiperidin-1-yl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-chlorophenyl)-3-[(3R,5R)-3,5-dimethylpiperidin-1-yl]propanamide
CID 740080
N-(2-chlorophenyl)-3-(3,5-dimethylpiperidin-1-yl)propanamide;oxalic acid
CID 171154563
3-[(3R)-3-methylpiperidin-1-yl]-N-(2-phenylphenyl)propanamide
CID 30099813
N-(2-chlorophenyl)-3-pyrrolidin-1-ylpropanamide;oxalic acid
CID 171154554
3-[(3S)-3-methylpiperidin-1-yl]-N-phenylpropanamide
CID 739976
ethyl (3S)-1-[3-(2-chloroanilino)-3-oxopropyl]piperidine-3-carboxylate
CID 771185
ethyl 1-[3-(2-chloroanilino)-3-oxopropyl]piperidine-3-carboxylate
CID 2902079
N-(2-chlorophenyl)-3-[(3R)-3-hydroxypyrrolidin-1-yl]propanamide
CID 78963268
N-(4-chloro-2-methylphenyl)-3-(3-methylpiperidin-1-yl)propanamide
CID 109032944
N-(2-chlorophenyl)-2-[4-[2-[(3R)-3-methylpiperidin-1-yl]-2-oxoethyl]piperazin-1-yl]acetamide
CID 8799834
N-(2-chlorophenyl)-2-[4-[2-[(3S)-3-methylpiperidin-1-yl]-2-oxoethyl]piperazin-1-yl]acetamide
CID 8799844
3-(4-aminopiperidin-1-yl)-N-(2-chlorophenyl)propanamide
CID 43556671

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-3-(3-methylpiperidin-1-yl)propanamide?
The IUPAC name of N-(2-chlorophenyl)-3-(3-methylpiperidin-1-yl)propanamide (CID 3145302) is N-(2-chlorophenyl)-3-(3-methylpiperidin-1-yl)propanamide.
What is the SMILES notation for N-(2-chlorophenyl)-3-(3-methylpiperidin-1-yl)propanamide?
The canonical SMILES for N-(2-chlorophenyl)-3-(3-methylpiperidin-1-yl)propanamide is CC1CCCN(CCC(=O)Nc2ccccc2Cl)C1.
What is the InChIKey of N-(2-chlorophenyl)-3-(3-methylpiperidin-1-yl)propanamide?
The InChIKey is LJACRDNWPDYOBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O/c1-12-5-4-9-18(11-12)10-8-15(19)17-14-7-3-2-6-13(14)16/h2-3,6-7,12H,4-5,8-11H2,1H3,(H,17,19).
What are the key properties of N-(2-chlorophenyl)-3-(3-methylpiperidin-1-yl)propanamide?
N-(2-chlorophenyl)-3-(3-methylpiperidin-1-yl)propanamide has a molecular weight of 280.80 g/mol, XLogP of 3.40, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-3-(3-methylpiperidin-1-yl)propanamide is sourced from PubChem (CID 3145302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).