N-(3-chlorophenyl)-3-(4-methylpiperidin-1-yl)propanamide

C15H21ClN2O — CID 109014570

IUPACN-(3-chlorophenyl)-3-(4-methylpiperidin-1-yl)propanamide
SMILESCC1CCN(CCC(=O)Nc2cccc(Cl)c2)CC1
InChIInChI=1S/C15H21ClN2O/c1-12-5-8-18(9-6-12)10-7-15(19)17-14-4-2-3-13(16)11-14/h2-4,11-12H,5-10H2,1H3,(H,17,19)
InChIKeyZGMOUKNXQHNPLP-UHFFFAOYSA-N
MW280.80 g/mol
LogP3.40
Rot. Bonds4

About N-(3-chlorophenyl)-3-(4-methylpiperidin-1-yl)propanamide

N-(3-chlorophenyl)-3-(4-methylpiperidin-1-yl)propanamide (PubChem CID 109014570) has the molecular formula C15H21ClN2O and a molecular weight of 280.80 g/mol. Its IUPAC name is N-(3-chlorophenyl)-3-(4-methylpiperidin-1-yl)propanamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-3-(4-methylpiperidin-1-yl)propanamide
PubChem CID109014570
Molecular FormulaC15H21ClN2O
Molecular Weight280.80 g/mol
Exact Mass280.13
IUPAC NameN-(3-chlorophenyl)-3-(4-methylpiperidin-1-yl)propanamide
SMILESCC1CCN(CCC(=O)Nc2cccc(Cl)c2)CC1
InChIInChI=1S/C15H21ClN2O/c1-12-5-8-18(9-6-12)10-7-15(19)17-14-4-2-3-13(16)11-14/h2-4,11-12H,5-10H2,1H3,(H,17,19)
InChIKeyZGMOUKNXQHNPLP-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

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Related Compounds

N-(3-chlorophenyl)-3-piperidin-1-ylpropanamide chloride
CID 53313683
3-(4-benzoylpiperidin-1-yl)-N-(3-chlorophenyl)propanamide
CID 33215010
3-[3-(aminomethyl)-4-methylpiperidin-1-yl]-N-(3-chlorophenyl)propanamide
CID 114961218
N-(3-aminophenyl)-3-(4-methylazepan-1-yl)propanamide
CID 63624788
3-[(3R)-3-aminopyrrolidin-1-yl]-N-(3-chlorophenyl)propanamide;hydrochloride
CID 119905402
N-(4-chloro-2-methylphenyl)-3-(4-methylpiperidin-1-yl)propanamide
CID 109014572
N-(3-chlorophenyl)-3-(4-phenylpiperazin-1-yl)propanamide;hydrochloride
CID 19661841
N-(3-chlorophenyl)-3-(1,4-diazepan-1-yl)propanamide
CID 43340911
N-(3-amino-4-fluorophenyl)-3-(4-methylpiperidin-1-yl)propanamide
CID 16778601
N-(3-chlorophenyl)-4-methylpiperidine-1-carboxamide
CID 707662
N-(3-chlorophenyl)-3-[4-[(S)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]propanamide
CID 124749868
N-[1-[3-(3-chloroanilino)-3-oxopropyl]piperidin-4-yl]thiophene-3-carboxamide
CID 47549626

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-3-(4-methylpiperidin-1-yl)propanamide?
The IUPAC name of N-(3-chlorophenyl)-3-(4-methylpiperidin-1-yl)propanamide (CID 109014570) is N-(3-chlorophenyl)-3-(4-methylpiperidin-1-yl)propanamide.
What is the SMILES notation for N-(3-chlorophenyl)-3-(4-methylpiperidin-1-yl)propanamide?
The canonical SMILES for N-(3-chlorophenyl)-3-(4-methylpiperidin-1-yl)propanamide is CC1CCN(CCC(=O)Nc2cccc(Cl)c2)CC1.
What is the InChIKey of N-(3-chlorophenyl)-3-(4-methylpiperidin-1-yl)propanamide?
The InChIKey is ZGMOUKNXQHNPLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O/c1-12-5-8-18(9-6-12)10-7-15(19)17-14-4-2-3-13(16)11-14/h2-4,11-12H,5-10H2,1H3,(H,17,19).
What are the key properties of N-(3-chlorophenyl)-3-(4-methylpiperidin-1-yl)propanamide?
N-(3-chlorophenyl)-3-(4-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-(3-chlorophenyl)-3-(4-methylpiperidin-1-yl)propanamide is sourced from PubChem (CID 109014570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).