2-amino-N-(1-benzothiophen-2-yl)benzamide

C15H12N2OS — CID 147635883

IUPAC2-amino-N-(1-benzothiophen-2-yl)benzamide
SMILESNc1ccccc1C(=O)Nc1cc2ccccc2s1
InChIInChI=1S/C15H12N2OS/c16-12-7-3-2-6-11(12)15(18)17-14-9-10-5-1-4-8-13(10)19-14/h1-9H,16H2,(H,17,18)
InChIKeyGGQAVFDVFPZIEO-UHFFFAOYSA-N
MW268.34 g/mol
LogP3.74
Rot. Bonds2

About 2-amino-N-(1-benzothiophen-2-yl)benzamide

2-amino-N-(1-benzothiophen-2-yl)benzamide (PubChem CID 147635883) has the molecular formula C15H12N2OS and a molecular weight of 268.34 g/mol. Its IUPAC name is 2-amino-N-(1-benzothiophen-2-yl)benzamide.

Molecular Properties

Compound Name2-amino-N-(1-benzothiophen-2-yl)benzamide
PubChem CID147635883
Molecular FormulaC15H12N2OS
Molecular Weight268.34 g/mol
Exact Mass268.07
IUPAC Name2-amino-N-(1-benzothiophen-2-yl)benzamide
SMILESNc1ccccc1C(=O)Nc1cc2ccccc2s1
InChIInChI=1S/C15H12N2OS/c16-12-7-3-2-6-11(12)15(18)17-14-9-10-5-1-4-8-13(10)19-14/h1-9H,16H2,(H,17,18)
InChIKeyGGQAVFDVFPZIEO-UHFFFAOYSA-N
XLogP3.74
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.34
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-(1,3-benzothiazol-2-yl)benzamide
CID 828314
1-benzothiophen-2-ylthiourea
CID 54554781
2-amino-N-anthracen-1-ylbenzamide
CID 175805968
1-(1-benzothiophen-2-yl)-3-(4-fluorophenyl)urea
CID 2811404
N-(1-benzothiophen-2-yl)cyclooctanecarboxamide
CID 150772406
[2-(1-benzothiophen-2-ylamino)-1-phosphono-2-sulfanylideneethyl]phosphonic acid
CID 14151783
N-(2-amino-6-chlorophenyl)-1-benzothiophene-2-carboxamide
CID 62085161
2-amino-N-(5-amino-1,3-thiazol-2-yl)benzamide
CID 166871884
N-(1-benzothiophen-2-yl)adamantane-2-carboxamide
CID 151004349
[2-[(2-aminobenzoyl)amino]phenyl]carbamic acid
CID 69256283
N-(4-aminophenyl)-1-benzothiophene-2-carboxamide
CID 22612941
2-amino-N-(3-hydroxyphenyl)benzamide
CID 3596059

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-benzothiophen-2-yl)benzamide?
The IUPAC name of 2-amino-N-(1-benzothiophen-2-yl)benzamide (CID 147635883) is 2-amino-N-(1-benzothiophen-2-yl)benzamide.
What is the SMILES notation for 2-amino-N-(1-benzothiophen-2-yl)benzamide?
The canonical SMILES for 2-amino-N-(1-benzothiophen-2-yl)benzamide is Nc1ccccc1C(=O)Nc1cc2ccccc2s1.
What is the InChIKey of 2-amino-N-(1-benzothiophen-2-yl)benzamide?
The InChIKey is GGQAVFDVFPZIEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2OS/c16-12-7-3-2-6-11(12)15(18)17-14-9-10-5-1-4-8-13(10)19-14/h1-9H,16H2,(H,17,18).
What are the key properties of 2-amino-N-(1-benzothiophen-2-yl)benzamide?
2-amino-N-(1-benzothiophen-2-yl)benzamide has a molecular weight of 268.34 g/mol, XLogP of 3.74, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-benzothiophen-2-yl)benzamide is sourced from PubChem (CID 147635883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).