N-(5-chloro-2-methylphenyl)-2-(1-methylpiperidin-4-yl)acetamide

C15H21ClN2O — CID 95969556

IUPACN-(5-chloro-2-methylphenyl)-2-(1-methylpiperidin-4-yl)acetamide
SMILESCc1ccc(Cl)cc1NC(=O)CC1CCN(C)CC1
InChIInChI=1S/C15H21ClN2O/c1-11-3-4-13(16)10-14(11)17-15(19)9-12-5-7-18(2)8-6-12/h3-4,10,12H,5-9H2,1-2H3,(H,17,19)
InChIKeyPOFQENNDSMITLR-UHFFFAOYSA-N
MW280.80 g/mol
LogP3.32
Rot. Bonds3

About N-(5-chloro-2-methylphenyl)-2-(1-methylpiperidin-4-yl)acetamide

N-(5-chloro-2-methylphenyl)-2-(1-methylpiperidin-4-yl)acetamide (PubChem CID 95969556) has the molecular formula C15H21ClN2O and a molecular weight of 280.80 g/mol. Its IUPAC name is N-(5-chloro-2-methylphenyl)-2-(1-methylpiperidin-4-yl)acetamide.

Molecular Properties

Compound NameN-(5-chloro-2-methylphenyl)-2-(1-methylpiperidin-4-yl)acetamide
PubChem CID95969556
Molecular FormulaC15H21ClN2O
Molecular Weight280.80 g/mol
Exact Mass280.13
IUPAC NameN-(5-chloro-2-methylphenyl)-2-(1-methylpiperidin-4-yl)acetamide
SMILESCc1ccc(Cl)cc1NC(=O)CC1CCN(C)CC1
InChIInChI=1S/C15H21ClN2O/c1-11-3-4-13(16)10-14(11)17-15(19)9-12-5-7-18(2)8-6-12/h3-4,10,12H,5-9H2,1-2H3,(H,17,19)
InChIKeyPOFQENNDSMITLR-UHFFFAOYSA-N
XLogP3.32
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.80
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(5-chloro-2-methylphenyl)-2-(1-methylpiperidin-4-yl)acetamide 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'-(5-chloro-2-methylphenyl)-N-[(1-methylpiperidin-4-yl)methyl]oxamide
CID 16886563
N-(2,4-dimethylphenyl)-2-(1-methylpiperidin-4-yl)acetamide
CID 95969538
[4-chloro-2-[(2-cyclopropylacetyl)amino]phenyl]boronic acid
CID 164645579
N,N'-bis(5-chloro-2-methylphenyl)propanediamide
CID 1340673
N-(5-chloro-2-methylphenyl)-2-[(3-hydroxycyclopentyl)methylamino]acetamide
CID 106129889
(2S)-4-(5-chloro-2-methylanilino)-2-(4-methylpiperazin-1-yl)-4-oxobutanoic acid
CID 7422185
N-(3-chloro-4-methylphenyl)-2-(1-methylpyrrolidin-3-yl)acetamide
CID 110859269
N-(5-chloro-2-methylphenyl)-2-(cyclopropylamino)acetamide
CID 43405290
N-(5-chloro-2-methylphenyl)-2-[3-(cyclopropylmethoxy)propylamino]acetamide
CID 103603858
N-(2,4-dimethylphenyl)-2-(1-methylpyrrolidin-3-yl)acetamide
CID 110857203
2-cyclopentyl-N-(2,5-dichlorophenyl)acetamide
CID 7733768
N-(5-chloro-2-methylphenyl)-2-[(4-chlorophenyl)methylamino]acetamide
CID 43405190

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methylphenyl)-2-(1-methylpiperidin-4-yl)acetamide?
The IUPAC name of N-(5-chloro-2-methylphenyl)-2-(1-methylpiperidin-4-yl)acetamide (CID 95969556) is N-(5-chloro-2-methylphenyl)-2-(1-methylpiperidin-4-yl)acetamide.
What is the SMILES notation for N-(5-chloro-2-methylphenyl)-2-(1-methylpiperidin-4-yl)acetamide?
The canonical SMILES for N-(5-chloro-2-methylphenyl)-2-(1-methylpiperidin-4-yl)acetamide is Cc1ccc(Cl)cc1NC(=O)CC1CCN(C)CC1.
What is the InChIKey of N-(5-chloro-2-methylphenyl)-2-(1-methylpiperidin-4-yl)acetamide?
The InChIKey is POFQENNDSMITLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O/c1-11-3-4-13(16)10-14(11)17-15(19)9-12-5-7-18(2)8-6-12/h3-4,10,12H,5-9H2,1-2H3,(H,17,19).
What are the key properties of N-(5-chloro-2-methylphenyl)-2-(1-methylpiperidin-4-yl)acetamide?
N-(5-chloro-2-methylphenyl)-2-(1-methylpiperidin-4-yl)acetamide has a molecular weight of 280.80 g/mol, XLogP of 3.32, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methylphenyl)-2-(1-methylpiperidin-4-yl)acetamide is sourced from PubChem (CID 95969556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).