4-amino-5-chloro-2-methoxy-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide

C19H20ClN3O3 — CID 119724540

IUPAC4-amino-5-chloro-2-methoxy-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide
SMILESCOc1cc(N)c(Cl)cc1C(=O)Nc1cccc(N2CCCCC2=O)c1
InChIInChI=1S/C19H20ClN3O3/c1-26-17-11-16(21)15(20)10-14(17)19(25)22-12-5-4-6-13(9-12)23-8-3-2-7-18(23)24/h4-6,9-11H,2-3,7-8,21H2,1H3,(H,22,25)
InChIKeyMCLUZGSWYHGTKN-UHFFFAOYSA-N
MW373.84 g/mol
LogP3.70
Rot. Bonds4

About 4-amino-5-chloro-2-methoxy-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide

4-amino-5-chloro-2-methoxy-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide (PubChem CID 119724540) has the molecular formula C19H20ClN3O3 and a molecular weight of 373.84 g/mol. Its IUPAC name is 4-amino-5-chloro-2-methoxy-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide.

Molecular Properties

Compound Name4-amino-5-chloro-2-methoxy-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide
PubChem CID119724540
Molecular FormulaC19H20ClN3O3
Molecular Weight373.84 g/mol
Exact Mass373.12
IUPAC Name4-amino-5-chloro-2-methoxy-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide
SMILESCOc1cc(N)c(Cl)cc1C(=O)Nc1cccc(N2CCCCC2=O)c1
InChIInChI=1S/C19H20ClN3O3/c1-26-17-11-16(21)15(20)10-14(17)19(25)22-12-5-4-6-13(9-12)23-8-3-2-7-18(23)24/h4-6,9-11H,2-3,7-8,21H2,1H3,(H,22,25)
InChIKeyMCLUZGSWYHGTKN-UHFFFAOYSA-N
XLogP3.70
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.84
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 4-amino-5-chloro-2-methoxy-N-[3-(2-oxopiperidin-1-yl)phenyl]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

2,4-dimethoxy-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide
CID 7687662
4-amino-5-chloro-2-methoxy-N-[1-[3-(2-oxopyrrolidin-1-yl)phenyl]ethyl]benzamide
CID 119756019
3,4,5-trimethoxy-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide
CID 7687589
3,4-dimethoxy-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide
CID 7687664
3-methoxy-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide
CID 7687642
5-amino-2-methyl-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide
CID 120622526
5-amino-2-methyl-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide;hydrochloride
CID 120622525
2-chloro-N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 7686645
2-chloro-4-fluoro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 17487375
8-methoxy-2-oxo-N-[3-(2-oxopyrrolidin-1-yl)phenyl]chromene-3-carboxamide
CID 26458989
N'-(5-chloro-2-methoxyphenyl)-N-[3-(2-oxopyrrolidin-1-yl)phenyl]oxamide
CID 44901687
1-(2-methoxyphenyl)-3-[3-(2-oxopyrrolidin-1-yl)phenyl]urea
CID 27870009

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-chloro-2-methoxy-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide?
The IUPAC name of 4-amino-5-chloro-2-methoxy-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide (CID 119724540) is 4-amino-5-chloro-2-methoxy-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide.
What is the SMILES notation for 4-amino-5-chloro-2-methoxy-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide?
The canonical SMILES for 4-amino-5-chloro-2-methoxy-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide is COc1cc(N)c(Cl)cc1C(=O)Nc1cccc(N2CCCCC2=O)c1.
What is the InChIKey of 4-amino-5-chloro-2-methoxy-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide?
The InChIKey is MCLUZGSWYHGTKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClN3O3/c1-26-17-11-16(21)15(20)10-14(17)19(25)22-12-5-4-6-13(9-12)23-8-3-2-7-18(23)24/h4-6,9-11H,2-3,7-8,21H2,1H3,(H,22,25).
What are the key properties of 4-amino-5-chloro-2-methoxy-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide?
4-amino-5-chloro-2-methoxy-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide has a molecular weight of 373.84 g/mol, XLogP of 3.70, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-chloro-2-methoxy-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide is sourced from PubChem (CID 119724540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).