2-chloro-5-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-N,N-dimethylbenzamide

C17H17ClN2O3 — CID 86851775

IUPAC2-chloro-5-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-N,N-dimethylbenzamide
SMILESCN(C)C(=O)c1cc(NC(=O)C2CC2c2ccco2)ccc1Cl
InChIInChI=1S/C17H17ClN2O3/c1-20(2)17(22)13-8-10(5-6-14(13)18)19-16(21)12-9-11(12)15-4-3-7-23-15/h3-8,11-12H,9H2,1-2H3,(H,19,21)
InChIKeyJSMDZXLRQXAETM-UHFFFAOYSA-N
MW332.79 g/mol
LogP3.38
Rot. Bonds4

About 2-chloro-5-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-N,N-dimethylbenzamide

2-chloro-5-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-N,N-dimethylbenzamide (PubChem CID 86851775) has the molecular formula C17H17ClN2O3 and a molecular weight of 332.79 g/mol. Its IUPAC name is 2-chloro-5-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-N,N-dimethylbenzamide.

Molecular Properties

Compound Name2-chloro-5-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-N,N-dimethylbenzamide
PubChem CID86851775
Molecular FormulaC17H17ClN2O3
Molecular Weight332.79 g/mol
Exact Mass332.09
IUPAC Name2-chloro-5-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-N,N-dimethylbenzamide
SMILESCN(C)C(=O)c1cc(NC(=O)C2CC2c2ccco2)ccc1Cl
InChIInChI=1S/C17H17ClN2O3/c1-20(2)17(22)13-8-10(5-6-14(13)18)19-16(21)12-9-11(12)15-4-3-7-23-15/h3-8,11-12H,9H2,1-2H3,(H,19,21)
InChIKeyJSMDZXLRQXAETM-UHFFFAOYSA-N
XLogP3.38
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.79
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-chloro-5-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-N,N-dimethylbenzamide 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

trans-(1R,2R)-N-(5-acetamido-2-chlorophenyl)-2-(furan-2-yl)cyclopropane-1-carboxamide
CID 95178804
N-(3-acetamido-4-methylphenyl)-2-(furan-2-yl)cyclopropane-1-carboxamide
CID 86851825
4-amino-N-[4-chloro-3-(dimethylcarbamoyl)phenyl]oxolane-3-carboxamide
CID 66240431
N-(4-chloro-2-methylphenyl)-2-(furan-2-yl)cyclopropane-1-carboxamide
CID 47449751
4-[[(1R,2R)-2-(furan-2-yl)cyclopropanecarbonyl]amino]-3-methoxy-N,N-dimethylbenzamide
CID 96528991
N-[4-chloro-3-(dimethylcarbamoyl)phenyl]-2-methylpyrrolidine-3-carboxamide
CID 79378598
methyl 4-chloro-3-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]benzoate
CID 86851547
5-[[(1R,2R)-2-(furan-2-yl)cyclopropanecarbonyl]amino]-1-N,3-N-dimethylbenzene-1,3-dicarboxamide
CID 166375052
N-[2-(dimethylamino)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide
CID 47449970
ethyl N-[4-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]phenyl]carbamate
CID 86851812
N-(4-ethoxy-3-fluorophenyl)-2-(furan-2-yl)cyclopropane-1-carboxamide
CID 86851939
2-(furan-2-yl)-N-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)cyclopropane-1-carboxamide
CID 86852022

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-N,N-dimethylbenzamide?
The IUPAC name of 2-chloro-5-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-N,N-dimethylbenzamide (CID 86851775) is 2-chloro-5-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-N,N-dimethylbenzamide.
What is the SMILES notation for 2-chloro-5-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-N,N-dimethylbenzamide?
The canonical SMILES for 2-chloro-5-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-N,N-dimethylbenzamide is CN(C)C(=O)c1cc(NC(=O)C2CC2c2ccco2)ccc1Cl.
What is the InChIKey of 2-chloro-5-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-N,N-dimethylbenzamide?
The InChIKey is JSMDZXLRQXAETM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN2O3/c1-20(2)17(22)13-8-10(5-6-14(13)18)19-16(21)12-9-11(12)15-4-3-7-23-15/h3-8,11-12H,9H2,1-2H3,(H,19,21).
What are the key properties of 2-chloro-5-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-N,N-dimethylbenzamide?
2-chloro-5-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-N,N-dimethylbenzamide has a molecular weight of 332.79 g/mol, XLogP of 3.38, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]-N,N-dimethylbenzamide is sourced from PubChem (CID 86851775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).