2-(3-chlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide

C15H21ClN2O — CID 110464819

IUPAC2-(3-chlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide
SMILESCC(C)(C(=O)NC1CCNCC1)c1cccc(Cl)c1
InChIInChI=1S/C15H21ClN2O/c1-15(2,11-4-3-5-12(16)10-11)14(19)18-13-6-8-17-9-7-13/h3-5,10,13,17H,6-9H2,1-2H3,(H,18,19)
InChIKeyVUNNLRVFYSKDBR-UHFFFAOYSA-N
MW280.80 g/mol
LogP2.49
Rot. Bonds3

About 2-(3-chlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide

2-(3-chlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide (PubChem CID 110464819) has the molecular formula C15H21ClN2O and a molecular weight of 280.80 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide.

Molecular Properties

Compound Name2-(3-chlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide
PubChem CID110464819
Molecular FormulaC15H21ClN2O
Molecular Weight280.80 g/mol
Exact Mass280.13
IUPAC Name2-(3-chlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide
SMILESCC(C)(C(=O)NC1CCNCC1)c1cccc(Cl)c1
InChIInChI=1S/C15H21ClN2O/c1-15(2,11-4-3-5-12(16)10-11)14(19)18-13-6-8-17-9-7-13/h3-5,10,13,17H,6-9H2,1-2H3,(H,18,19)
InChIKeyVUNNLRVFYSKDBR-UHFFFAOYSA-N
XLogP2.49
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.80
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-chlorophenyl)-2-methyl-N-(3-methylpiperidin-4-yl)propanamide;hydrochloride
CID 120554098
2-methyl-2-phenyl-N-pyrrolidin-3-ylpropanamide
CID 43603539
2-(4-fluorophenyl)-2-methyl-N-piperidin-4-ylpropanamide
CID 119387447
2-(4-bromophenyl)-2-methyl-N-piperidin-4-ylpropanamide;hydrochloride
CID 119390315
2-(3-chlorophenyl)-2-methyl-N-(2-piperidin-3-ylethyl)propanamide
CID 119555390
2-methyl-N-piperidin-4-yl-2-thiophen-2-ylpropanamide
CID 119389269
2-(3-chlorophenyl)-2-methyl-1-piperazin-1-ylpropan-1-one;hydrochloride
CID 119400424
2-(4-chloro-2-fluorophenoxy)-2-methyl-N-piperidin-4-ylpropanamide
CID 142458000
2-(4-chlorophenyl)-N-cyclopentyl-2-methylpropanamide
CID 47300023
2-(4-bromophenyl)-2-methyl-N-pyrrolidin-3-ylpropanamide
CID 119454206
N-(2-amino-1-cyclopropylethyl)-2-(3-chlorophenyl)-2-methylpropanamide
CID 119613199
2-(3-chlorophenyl)-2-methylpropanoic acid
CID 15582644

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide?
The IUPAC name of 2-(3-chlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide (CID 110464819) is 2-(3-chlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide.
What is the SMILES notation for 2-(3-chlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide?
The canonical SMILES for 2-(3-chlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide is CC(C)(C(=O)NC1CCNCC1)c1cccc(Cl)c1.
What is the InChIKey of 2-(3-chlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide?
The InChIKey is VUNNLRVFYSKDBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O/c1-15(2,11-4-3-5-12(16)10-11)14(19)18-13-6-8-17-9-7-13/h3-5,10,13,17H,6-9H2,1-2H3,(H,18,19).
What are the key properties of 2-(3-chlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide?
2-(3-chlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide has a molecular weight of 280.80 g/mol, XLogP of 2.49, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide is sourced from PubChem (CID 110464819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).