3-chloro-2-methyl-N-(2-methylpiperidin-3-yl)benzamide

C14H19ClN2O — CID 107098369

IUPAC3-chloro-2-methyl-N-(2-methylpiperidin-3-yl)benzamide
SMILESCc1c(Cl)cccc1C(=O)NC1CCCNC1C
InChIInChI=1S/C14H19ClN2O/c1-9-11(5-3-6-12(9)15)14(18)17-13-7-4-8-16-10(13)2/h3,5-6,10,13,16H,4,7-8H2,1-2H3,(H,17,18)
InChIKeyPTSQHBJTEPLEEJ-UHFFFAOYSA-N
MW266.77 g/mol
LogP2.52
Rot. Bonds2

About 3-chloro-2-methyl-N-(2-methylpiperidin-3-yl)benzamide

3-chloro-2-methyl-N-(2-methylpiperidin-3-yl)benzamide (PubChem CID 107098369) has the molecular formula C14H19ClN2O and a molecular weight of 266.77 g/mol. Its IUPAC name is 3-chloro-2-methyl-N-(2-methylpiperidin-3-yl)benzamide.

Molecular Properties

Compound Name3-chloro-2-methyl-N-(2-methylpiperidin-3-yl)benzamide
PubChem CID107098369
Molecular FormulaC14H19ClN2O
Molecular Weight266.77 g/mol
Exact Mass266.12
IUPAC Name3-chloro-2-methyl-N-(2-methylpiperidin-3-yl)benzamide
SMILESCc1c(Cl)cccc1C(=O)NC1CCCNC1C
InChIInChI=1S/C14H19ClN2O/c1-9-11(5-3-6-12(9)15)14(18)17-13-7-4-8-16-10(13)2/h3,5-6,10,13,16H,4,7-8H2,1-2H3,(H,17,18)
InChIKeyPTSQHBJTEPLEEJ-UHFFFAOYSA-N
XLogP2.52
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.77
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-chloro-2-methyl-N-(2-methylpiperidin-3-yl)benzamide 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

2,3-dimethyl-N-(2-methylpiperidin-3-yl)benzamide
CID 79042389
N-(2-aminocycloheptyl)-3-chloro-2-methylbenzamide
CID 107098127
3-methyl-N-[(2S,3S)-2-methylpiperidin-3-yl]benzamide
CID 124515685
N-[(2R,3R)-2-methylpiperidin-3-yl]benzamide
CID 124511336
3-chloro-2-methyl-N-[(3S)-pyrrolidin-3-yl]benzamide
CID 107098265
3-chloro-N-cyclohexyl-2-methylbenzamide;pyrrolidine
CID 143582754
2,4-dichloro-5-fluoro-N-(2-methylpiperidin-3-yl)benzamide
CID 120575501
3-chloro-2-methyl-N-(2-pyrrolidin-2-ylethyl)benzamide
CID 107098372
3-(2-chloro-6-fluorophenyl)-5-methyl-N-(2-methylpiperidin-3-yl)-1,2-oxazole-4-carboxamide
CID 120575010
2,5-dichloro-N-(2-methylpiperidin-3-yl)thiophene-3-carboxamide
CID 106813442
2-bromo-4-chloro-N-(2-methylpiperidin-3-yl)benzamide
CID 106813439
5-chloro-2-iodo-N-(2-methylpiperidin-3-yl)benzamide
CID 106813444

Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-methyl-N-(2-methylpiperidin-3-yl)benzamide?
The IUPAC name of 3-chloro-2-methyl-N-(2-methylpiperidin-3-yl)benzamide (CID 107098369) is 3-chloro-2-methyl-N-(2-methylpiperidin-3-yl)benzamide.
What is the SMILES notation for 3-chloro-2-methyl-N-(2-methylpiperidin-3-yl)benzamide?
The canonical SMILES for 3-chloro-2-methyl-N-(2-methylpiperidin-3-yl)benzamide is Cc1c(Cl)cccc1C(=O)NC1CCCNC1C.
What is the InChIKey of 3-chloro-2-methyl-N-(2-methylpiperidin-3-yl)benzamide?
The InChIKey is PTSQHBJTEPLEEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O/c1-9-11(5-3-6-12(9)15)14(18)17-13-7-4-8-16-10(13)2/h3,5-6,10,13,16H,4,7-8H2,1-2H3,(H,17,18).
What are the key properties of 3-chloro-2-methyl-N-(2-methylpiperidin-3-yl)benzamide?
3-chloro-2-methyl-N-(2-methylpiperidin-3-yl)benzamide has a molecular weight of 266.77 g/mol, XLogP of 2.52, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-methyl-N-(2-methylpiperidin-3-yl)benzamide is sourced from PubChem (CID 107098369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).