1-(2-amino-5-chlorobenzoyl)-N,N-dimethylpiperidine-4-carboxamide

C15H20ClN3O2 — CID 61106212

IUPAC1-(2-amino-5-chlorobenzoyl)-N,N-dimethylpiperidine-4-carboxamide
SMILESCN(C)C(=O)C1CCN(C(=O)c2cc(Cl)ccc2N)CC1
InChIInChI=1S/C15H20ClN3O2/c1-18(2)14(20)10-5-7-19(8-6-10)15(21)12-9-11(16)3-4-13(12)17/h3-4,9-10H,5-8,17H2,1-2H3
InChIKeyUBGWWDLCLCZNPU-UHFFFAOYSA-N
MW309.80 g/mol
LogP1.86
Rot. Bonds2

About 1-(2-amino-5-chlorobenzoyl)-N,N-dimethylpiperidine-4-carboxamide

1-(2-amino-5-chlorobenzoyl)-N,N-dimethylpiperidine-4-carboxamide (PubChem CID 61106212) has the molecular formula C15H20ClN3O2 and a molecular weight of 309.80 g/mol. Its IUPAC name is 1-(2-amino-5-chlorobenzoyl)-N,N-dimethylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-amino-5-chlorobenzoyl)-N,N-dimethylpiperidine-4-carboxamide
PubChem CID61106212
Molecular FormulaC15H20ClN3O2
Molecular Weight309.80 g/mol
Exact Mass309.12
IUPAC Name1-(2-amino-5-chlorobenzoyl)-N,N-dimethylpiperidine-4-carboxamide
SMILESCN(C)C(=O)C1CCN(C(=O)c2cc(Cl)ccc2N)CC1
InChIInChI=1S/C15H20ClN3O2/c1-18(2)14(20)10-5-7-19(8-6-10)15(21)12-9-11(16)3-4-13(12)17/h3-4,9-10H,5-8,17H2,1-2H3
InChIKeyUBGWWDLCLCZNPU-UHFFFAOYSA-N
XLogP1.86
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.80
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 1-(2-amino-5-chlorobenzoyl)-N,N-dimethylpiperidine-4-carboxamide 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-amino-5-chlorophenyl)-(4-methylpiperidin-1-yl)methanone
CID 16772124
(2-amino-5-chlorophenyl)-[4-(diethylamino)piperidin-1-yl]methanone
CID 61115199
1-(2-bromo-5-chlorobenzoyl)-N-methyl-N-propan-2-ylpiperidine-4-carboxamide
CID 78864334
(2-amino-5-chlorophenyl)-morpholin-4-ylmethanone
CID 16776415
1-(5-bromo-2-methylbenzoyl)-N,N-dimethylpiperidine-4-carboxamide
CID 65309546
(2-amino-5-chlorophenyl)-[4-(cyclopropylmethyl)piperazin-1-yl]methanone
CID 61108944
1-(5-chloro-2-methoxybenzoyl)-N-cyclopropyl-N-methylpiperidine-4-carboxamide
CID 55627034
1-(2,4-dimethylbenzoyl)-N,N-dimethylpiperidine-4-carboxamide
CID 84546564
1-(3,4-difluorobenzoyl)-N,N-dimethylpiperidine-4-carboxamide
CID 110350822
(2-amino-5-chlorophenyl)-[(3S)-3-hydroxypiperidin-1-yl]methanone
CID 107211689
1-(5,6-dichloropyridine-3-carbonyl)-N,N-dimethylpiperidine-4-carboxamide
CID 60637345
1-(2-chloropyridine-4-carbonyl)-N,N-dimethylpiperidine-4-carboxamide
CID 47124151

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-5-chlorobenzoyl)-N,N-dimethylpiperidine-4-carboxamide?
The IUPAC name of 1-(2-amino-5-chlorobenzoyl)-N,N-dimethylpiperidine-4-carboxamide (CID 61106212) is 1-(2-amino-5-chlorobenzoyl)-N,N-dimethylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(2-amino-5-chlorobenzoyl)-N,N-dimethylpiperidine-4-carboxamide?
The canonical SMILES for 1-(2-amino-5-chlorobenzoyl)-N,N-dimethylpiperidine-4-carboxamide is CN(C)C(=O)C1CCN(C(=O)c2cc(Cl)ccc2N)CC1.
What is the InChIKey of 1-(2-amino-5-chlorobenzoyl)-N,N-dimethylpiperidine-4-carboxamide?
The InChIKey is UBGWWDLCLCZNPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClN3O2/c1-18(2)14(20)10-5-7-19(8-6-10)15(21)12-9-11(16)3-4-13(12)17/h3-4,9-10H,5-8,17H2,1-2H3.
What are the key properties of 1-(2-amino-5-chlorobenzoyl)-N,N-dimethylpiperidine-4-carboxamide?
1-(2-amino-5-chlorobenzoyl)-N,N-dimethylpiperidine-4-carboxamide has a molecular weight of 309.80 g/mol, XLogP of 1.86, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-5-chlorobenzoyl)-N,N-dimethylpiperidine-4-carboxamide is sourced from PubChem (CID 61106212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).