2-chloro-4-(furan-2-yl)-N-methylbenzamide

C12H10ClNO2 — CID 168525512

IUPAC2-chloro-4-(furan-2-yl)-N-methylbenzamide
SMILESCNC(=O)c1ccc(-c2ccco2)cc1Cl
InChIInChI=1S/C12H10ClNO2/c1-14-12(15)9-5-4-8(7-10(9)13)11-3-2-6-16-11/h2-7H,1H3,(H,14,15)
InChIKeyRPNDSLJJUMLWBL-UHFFFAOYSA-N
MW235.67 g/mol
LogP2.96
Rot. Bonds2

About 2-chloro-4-(furan-2-yl)-N-methylbenzamide

2-chloro-4-(furan-2-yl)-N-methylbenzamide (PubChem CID 168525512) has the molecular formula C12H10ClNO2 and a molecular weight of 235.67 g/mol. Its IUPAC name is 2-chloro-4-(furan-2-yl)-N-methylbenzamide.

Molecular Properties

Compound Name2-chloro-4-(furan-2-yl)-N-methylbenzamide
PubChem CID168525512
Molecular FormulaC12H10ClNO2
Molecular Weight235.67 g/mol
Exact Mass235.04
IUPAC Name2-chloro-4-(furan-2-yl)-N-methylbenzamide
SMILESCNC(=O)c1ccc(-c2ccco2)cc1Cl
InChIInChI=1S/C12H10ClNO2/c1-14-12(15)9-5-4-8(7-10(9)13)11-3-2-6-16-11/h2-7H,1H3,(H,14,15)
InChIKeyRPNDSLJJUMLWBL-UHFFFAOYSA-N
XLogP2.96
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.67
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-5-(furan-2-yl)-N-methylbenzamide
CID 168525507
methyl 2-chloro-5-(furan-2-yl)benzoate
CID 168524498
2-chloro-4-(furan-2-yl)benzenecarbothioamide
CID 168528701
2,4-dichloro-N-[4-(furan-2-yl)-2-propanoylphenyl]benzamide
CID 142203101
2,4-dichloro-N-[3-(furan-2-yl)phenyl]benzamide
CID 168526277
2-[(2,4-dichlorobenzoyl)amino]-5-(furan-2-yl)benzoic acid
CID 10270857
N-[2-chloro-4-(furan-2-yl)phenyl]-2,2-dimethylpropanamide
CID 168527698
2-chloro-N-[6-(furan-2-yl)quinazolin-2-yl]-4-methoxybenzamide
CID 175274623
2-chloro-N,4-dimethylbenzamide;ethane
CID 143942674
4-(furan-2-yl)-2-methoxybenzoic acid
CID 53224787
3-fluoro-2-(furan-2-yl)-N-methylbenzamide
CID 168527432
N-[3-chloro-4-(methylcarbamoyl)phenyl]methanimine oxide
CID 90398217

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-(furan-2-yl)-N-methylbenzamide?
The IUPAC name of 2-chloro-4-(furan-2-yl)-N-methylbenzamide (CID 168525512) is 2-chloro-4-(furan-2-yl)-N-methylbenzamide.
What is the SMILES notation for 2-chloro-4-(furan-2-yl)-N-methylbenzamide?
The canonical SMILES for 2-chloro-4-(furan-2-yl)-N-methylbenzamide is CNC(=O)c1ccc(-c2ccco2)cc1Cl.
What is the InChIKey of 2-chloro-4-(furan-2-yl)-N-methylbenzamide?
The InChIKey is RPNDSLJJUMLWBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClNO2/c1-14-12(15)9-5-4-8(7-10(9)13)11-3-2-6-16-11/h2-7H,1H3,(H,14,15).
What are the key properties of 2-chloro-4-(furan-2-yl)-N-methylbenzamide?
2-chloro-4-(furan-2-yl)-N-methylbenzamide has a molecular weight of 235.67 g/mol, XLogP of 2.96, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-(furan-2-yl)-N-methylbenzamide is sourced from PubChem (CID 168525512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).