(2R)-N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]piperidine-2-carboxamide;hydrochloride

C16H24ClN3O2 — CID 119694200

IUPAC(2R)-N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]piperidine-2-carboxamide;hydrochloride
SMILESCNC(=O)c1ccc(CN(C)C(=O)[C@H]2CCCCN2)cc1.Cl
InChIInChI=1S/C16H23N3O2.ClH/c1-17-15(20)13-8-6-12(7-9-13)11-19(2)16(21)14-5-3-4-10-18-14;/h6-9,14,18H,3-5,10-11H2,1-2H3,(H,17,20);1H/t14-;/m1./s1
InChIKeyFEPJXJMEWQNYDO-PFEQFJNWSA-N
MW325.84 g/mol
LogP1.57
Rot. Bonds4

About (2R)-N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]piperidine-2-carboxamide;hydrochloride

(2R)-N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]piperidine-2-carboxamide;hydrochloride (PubChem CID 119694200) has the molecular formula C16H24ClN3O2 and a molecular weight of 325.84 g/mol. Its IUPAC name is (2R)-N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]piperidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name(2R)-N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]piperidine-2-carboxamide;hydrochloride
PubChem CID119694200
Molecular FormulaC16H24ClN3O2
Molecular Weight325.84 g/mol
Exact Mass325.16
IUPAC Name(2R)-N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]piperidine-2-carboxamide;hydrochloride
SMILESCNC(=O)c1ccc(CN(C)C(=O)[C@H]2CCCCN2)cc1.Cl
InChIInChI=1S/C16H23N3O2.ClH/c1-17-15(20)13-8-6-12(7-9-13)11-19(2)16(21)14-5-3-4-10-18-14;/h6-9,14,18H,3-5,10-11H2,1-2H3,(H,17,20);1H/t14-;/m1./s1
InChIKeyFEPJXJMEWQNYDO-PFEQFJNWSA-N
XLogP1.57
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.84
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2R)-N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]piperidine-2-carboxamide;hydrochloride 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

(2S)-N-methyl-N-[(4-methylphenyl)methyl]piperidine-2-carboxamide;hydrochloride
CID 119681881
(2S)-N-[(4-bromophenyl)methyl]-N-methylpiperidine-2-carboxamide;hydrochloride
CID 119682587
N-[(4-chlorophenyl)methyl]-N-methylpiperidine-2-carboxamide
CID 54944765
(2S)-N-[(4-ethylphenyl)methyl]-N-methylpyrrolidine-2-carboxamide;hydrochloride
CID 119266906
N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-1,3-thiazolidine-4-carboxamide
CID 60944866
(2R)-N-methyl-N-[(4-methylsulfanylphenyl)methyl]piperidine-2-carboxamide
CID 93367508
(3R)-N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]piperidine-3-carboxamide
CID 81128292
(2R)-N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-5-oxopyrrolidine-2-carboxamide
CID 8966947
(2S)-N-[(3,4-difluorophenyl)methyl]-N-methylpiperidine-2-carboxamide;hydrochloride
CID 119717254
(2S)-N-benzyl-N-methylpyrrolidine-2-carboxamide
CID 22691346
N-methyl-N-(pyridin-3-ylmethyl)piperidine-2-carboxamide;dihydrochloride
CID 119958234
(2S,4S)-N,2-dimethyl-N-[[4-(methylcarbamoyl)phenyl]methyl]piperidine-4-carboxamide
CID 120618816

Frequently Asked Questions

What is the IUPAC name of (2R)-N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]piperidine-2-carboxamide;hydrochloride?
The IUPAC name of (2R)-N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]piperidine-2-carboxamide;hydrochloride (CID 119694200) is (2R)-N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]piperidine-2-carboxamide;hydrochloride.
What is the SMILES notation for (2R)-N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]piperidine-2-carboxamide;hydrochloride?
The canonical SMILES for (2R)-N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]piperidine-2-carboxamide;hydrochloride is CNC(=O)c1ccc(CN(C)C(=O)[C@H]2CCCCN2)cc1.Cl.
What is the InChIKey of (2R)-N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]piperidine-2-carboxamide;hydrochloride?
The InChIKey is FEPJXJMEWQNYDO-PFEQFJNWSA-N. The full InChI is InChI=1S/C16H23N3O2.ClH/c1-17-15(20)13-8-6-12(7-9-13)11-19(2)16(21)14-5-3-4-10-18-14;/h6-9,14,18H,3-5,10-11H2,1-2H3,(H,17,20);1H/t14-;/m1./s1.
What are the key properties of (2R)-N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]piperidine-2-carboxamide;hydrochloride?
(2R)-N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]piperidine-2-carboxamide;hydrochloride has a molecular weight of 325.84 g/mol, XLogP of 1.57, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]piperidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119694200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).