2-chloro-N-[(5-thiophen-2-ylfuran-2-yl)methyl]benzamide

C16H12ClNO2S — CID 119101790

IUPAC2-chloro-N-[(5-thiophen-2-ylfuran-2-yl)methyl]benzamide
SMILESO=C(NCc1ccc(-c2cccs2)o1)c1ccccc1Cl
InChIInChI=1S/C16H12ClNO2S/c17-13-5-2-1-4-12(13)16(19)18-10-11-7-8-14(20-11)15-6-3-9-21-15/h1-9H,10H2,(H,18,19)
InChIKeyRBIVFOLBUQRKEE-UHFFFAOYSA-N
MW317.80 g/mol
LogP4.59
Rot. Bonds4

About 2-chloro-N-[(5-thiophen-2-ylfuran-2-yl)methyl]benzamide

2-chloro-N-[(5-thiophen-2-ylfuran-2-yl)methyl]benzamide (PubChem CID 119101790) has the molecular formula C16H12ClNO2S and a molecular weight of 317.80 g/mol. Its IUPAC name is 2-chloro-N-[(5-thiophen-2-ylfuran-2-yl)methyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[(5-thiophen-2-ylfuran-2-yl)methyl]benzamide
PubChem CID119101790
Molecular FormulaC16H12ClNO2S
Molecular Weight317.80 g/mol
Exact Mass317.03
IUPAC Name2-chloro-N-[(5-thiophen-2-ylfuran-2-yl)methyl]benzamide
SMILESO=C(NCc1ccc(-c2cccs2)o1)c1ccccc1Cl
InChIInChI=1S/C16H12ClNO2S/c17-13-5-2-1-4-12(13)16(19)18-10-11-7-8-14(20-11)15-6-3-9-21-15/h1-9H,10H2,(H,18,19)
InChIKeyRBIVFOLBUQRKEE-UHFFFAOYSA-N
XLogP4.59
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.80
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-chloro-N-[(5-thiophen-2-ylfuran-2-yl)methyl]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-iodo-N-[(5-thiophen-2-ylfuran-2-yl)methyl]benzamide
CID 122264339
2-chloro-6-fluoro-N-[(5-thiophen-2-ylfuran-2-yl)methyl]benzamide
CID 121019111
2-chloro-N-[[5-(furan-2-yl)furan-2-yl]methyl]benzamide
CID 119101854
3-(2-chlorophenyl)-5-methyl-N-[(5-thiophen-2-ylfuran-2-yl)methyl]-1,2-oxazole-4-carboxamide
CID 122264336
N-[(5-thiophen-2-ylfuran-2-yl)methyl]-1-benzothiophene-2-carboxamide
CID 122264352
N-[[5-(4-bromophenyl)furan-2-yl]methyl]-2-chlorobenzamide
CID 9204124
N-[(5-thiophen-2-ylfuran-2-yl)methyl]cyclopentanecarboxamide
CID 122264205
2,2-diphenyl-N-[(5-thiophen-2-ylfuran-2-yl)methyl]acetamide
CID 122264322
2-chloro-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 110731650
1-propan-2-yl-3-[(5-thiophen-2-ylfuran-2-yl)methyl]urea
CID 122264543
2-chloro-N-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]benzamide
CID 93173363
N'-cyclopropyl-N-[(5-thiophen-2-ylfuran-2-yl)methyl]oxamide
CID 122264467

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[(5-thiophen-2-ylfuran-2-yl)methyl]benzamide?
The IUPAC name of 2-chloro-N-[(5-thiophen-2-ylfuran-2-yl)methyl]benzamide (CID 119101790) is 2-chloro-N-[(5-thiophen-2-ylfuran-2-yl)methyl]benzamide.
What is the SMILES notation for 2-chloro-N-[(5-thiophen-2-ylfuran-2-yl)methyl]benzamide?
The canonical SMILES for 2-chloro-N-[(5-thiophen-2-ylfuran-2-yl)methyl]benzamide is O=C(NCc1ccc(-c2cccs2)o1)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-[(5-thiophen-2-ylfuran-2-yl)methyl]benzamide?
The InChIKey is RBIVFOLBUQRKEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12ClNO2S/c17-13-5-2-1-4-12(13)16(19)18-10-11-7-8-14(20-11)15-6-3-9-21-15/h1-9H,10H2,(H,18,19).
What are the key properties of 2-chloro-N-[(5-thiophen-2-ylfuran-2-yl)methyl]benzamide?
2-chloro-N-[(5-thiophen-2-ylfuran-2-yl)methyl]benzamide has a molecular weight of 317.80 g/mol, XLogP of 4.59, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[(5-thiophen-2-ylfuran-2-yl)methyl]benzamide is sourced from PubChem (CID 119101790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).