4-chloro-2-methyl-N-[(5-phenylfuran-2-yl)methyl]benzamide

C19H16ClNO2 — CID 166341635

IUPAC4-chloro-2-methyl-N-[(5-phenylfuran-2-yl)methyl]benzamide
SMILESCc1cc(Cl)ccc1C(=O)NCc1ccc(-c2ccccc2)o1
InChIInChI=1S/C19H16ClNO2/c1-13-11-15(20)7-9-17(13)19(22)21-12-16-8-10-18(23-16)14-5-3-2-4-6-14/h2-11H,12H2,1H3,(H,21,22)
InChIKeyLFYUVEVQWKRQHM-UHFFFAOYSA-N
MW325.80 g/mol
LogP4.84
Rot. Bonds4

About 4-chloro-2-methyl-N-[(5-phenylfuran-2-yl)methyl]benzamide

4-chloro-2-methyl-N-[(5-phenylfuran-2-yl)methyl]benzamide (PubChem CID 166341635) has the molecular formula C19H16ClNO2 and a molecular weight of 325.80 g/mol. Its IUPAC name is 4-chloro-2-methyl-N-[(5-phenylfuran-2-yl)methyl]benzamide.

Molecular Properties

Compound Name4-chloro-2-methyl-N-[(5-phenylfuran-2-yl)methyl]benzamide
PubChem CID166341635
Molecular FormulaC19H16ClNO2
Molecular Weight325.80 g/mol
Exact Mass325.09
IUPAC Name4-chloro-2-methyl-N-[(5-phenylfuran-2-yl)methyl]benzamide
SMILESCc1cc(Cl)ccc1C(=O)NCc1ccc(-c2ccccc2)o1
InChIInChI=1S/C19H16ClNO2/c1-13-11-15(20)7-9-17(13)19(22)21-12-16-8-10-18(23-16)14-5-3-2-4-6-14/h2-11H,12H2,1H3,(H,21,22)
InChIKeyLFYUVEVQWKRQHM-UHFFFAOYSA-N
XLogP4.84
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.80
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-2,4-dimethoxybenzamide
CID 9021349
N-[[5-(4-bromophenyl)furan-2-yl]methyl]-2-chlorobenzamide
CID 9204124
N-[2-[[5-(4-chlorophenyl)furan-2-yl]methylamino]-2-oxoethyl]-2-phenylacetamide
CID 9120196
N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-6-methylpyridine-3-carboxamide
CID 31121475
N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-4-fluorobenzamide
CID 54858020
4-chloro-2-methyl-N-(1H-pyrrol-3-ylmethyl)benzamide
CID 106385485
N-[[5-(4-bromophenyl)furan-2-yl]methyl]-2-fluorobenzamide
CID 9204118
N-[[5-(4-bromophenyl)furan-2-yl]methyl]-2-(4-chloro-2-methylphenoxy)acetamide
CID 17335241
N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]benzamide
CID 46551445
N-[(4-bromothiophen-2-yl)methyl]-4-chloro-2-methylbenzamide
CID 103777410
N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-2-(thiophen-2-ylmethylsulfanyl)benzamide
CID 18227464
N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-3-(methoxymethyl)benzamide
CID 46674267

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-methyl-N-[(5-phenylfuran-2-yl)methyl]benzamide?
The IUPAC name of 4-chloro-2-methyl-N-[(5-phenylfuran-2-yl)methyl]benzamide (CID 166341635) is 4-chloro-2-methyl-N-[(5-phenylfuran-2-yl)methyl]benzamide.
What is the SMILES notation for 4-chloro-2-methyl-N-[(5-phenylfuran-2-yl)methyl]benzamide?
The canonical SMILES for 4-chloro-2-methyl-N-[(5-phenylfuran-2-yl)methyl]benzamide is Cc1cc(Cl)ccc1C(=O)NCc1ccc(-c2ccccc2)o1.
What is the InChIKey of 4-chloro-2-methyl-N-[(5-phenylfuran-2-yl)methyl]benzamide?
The InChIKey is LFYUVEVQWKRQHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClNO2/c1-13-11-15(20)7-9-17(13)19(22)21-12-16-8-10-18(23-16)14-5-3-2-4-6-14/h2-11H,12H2,1H3,(H,21,22).
What are the key properties of 4-chloro-2-methyl-N-[(5-phenylfuran-2-yl)methyl]benzamide?
4-chloro-2-methyl-N-[(5-phenylfuran-2-yl)methyl]benzamide has a molecular weight of 325.80 g/mol, XLogP of 4.84, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-methyl-N-[(5-phenylfuran-2-yl)methyl]benzamide is sourced from PubChem (CID 166341635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).