N-naphthalen-2-yl-4-thiophen-2-ylbenzamide

C21H15NOS — CID 59673380

IUPACN-naphthalen-2-yl-4-thiophen-2-ylbenzamide
SMILESO=C(Nc1ccc2ccccc2c1)c1ccc(-c2cccs2)cc1
InChIInChI=1S/C21H15NOS/c23-21(17-9-7-16(8-10-17)20-6-3-13-24-20)22-19-12-11-15-4-1-2-5-18(15)14-19/h1-14H,(H,22,23)
InChIKeyXHYNAKWMMRGCRE-UHFFFAOYSA-N
MW329.42 g/mol
LogP5.82
Rot. Bonds3

About N-naphthalen-2-yl-4-thiophen-2-ylbenzamide

N-naphthalen-2-yl-4-thiophen-2-ylbenzamide (PubChem CID 59673380) has the molecular formula C21H15NOS and a molecular weight of 329.42 g/mol. Its IUPAC name is N-naphthalen-2-yl-4-thiophen-2-ylbenzamide.

Molecular Properties

Compound NameN-naphthalen-2-yl-4-thiophen-2-ylbenzamide
PubChem CID59673380
Molecular FormulaC21H15NOS
Molecular Weight329.42 g/mol
Exact Mass329.09
IUPAC NameN-naphthalen-2-yl-4-thiophen-2-ylbenzamide
SMILESO=C(Nc1ccc2ccccc2c1)c1ccc(-c2cccs2)cc1
InChIInChI=1S/C21H15NOS/c23-21(17-9-7-16(8-10-17)20-6-3-13-24-20)22-19-12-11-15-4-1-2-5-18(15)14-19/h1-14H,(H,22,23)
InChIKeyXHYNAKWMMRGCRE-UHFFFAOYSA-N
XLogP5.82
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.42
LogP ≤ 55.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-naphthalen-2-yl-4-phenylbenzamide
CID 1228216
4-[4-(naphthalen-2-ylcarbamoyl)phenyl]-N-phenylbenzamide
CID 170421564
N-(3,4-dimethoxyphenyl)-4-thiophen-2-ylbenzamide
CID 1483506
N-[3-(naphthalene-2-carbonylamino)phenyl]thiophene-2-carboxamide
CID 1334806
N-(3-nitrophenyl)-4-thiophen-2-ylbenzamide
CID 4730837
N-(2-hydroxyphenyl)-4-thiophen-2-ylbenzamide
CID 944599
N-naphthalen-2-yl-4-propan-2-yloxybenzamide
CID 823400
N-naphthalen-2-yl-4-pyridin-2-ylbenzamide
CID 59673032
N-[4-(naphthalene-2-carbonylamino)phenyl]naphthalene-2-carboxamide
CID 5120135
N-naphthalen-2-yl-2-thiophen-2-ylquinoline-4-carboxamide
CID 2316962
4-ethyl-N-naphthalen-2-ylbenzamide
CID 5108081
N-naphthalen-2-yl-4-sulfamoylbenzamide
CID 24638963

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-2-yl-4-thiophen-2-ylbenzamide?
The IUPAC name of N-naphthalen-2-yl-4-thiophen-2-ylbenzamide (CID 59673380) is N-naphthalen-2-yl-4-thiophen-2-ylbenzamide.
What is the SMILES notation for N-naphthalen-2-yl-4-thiophen-2-ylbenzamide?
The canonical SMILES for N-naphthalen-2-yl-4-thiophen-2-ylbenzamide is O=C(Nc1ccc2ccccc2c1)c1ccc(-c2cccs2)cc1.
What is the InChIKey of N-naphthalen-2-yl-4-thiophen-2-ylbenzamide?
The InChIKey is XHYNAKWMMRGCRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15NOS/c23-21(17-9-7-16(8-10-17)20-6-3-13-24-20)22-19-12-11-15-4-1-2-5-18(15)14-19/h1-14H,(H,22,23).
What are the key properties of N-naphthalen-2-yl-4-thiophen-2-ylbenzamide?
N-naphthalen-2-yl-4-thiophen-2-ylbenzamide has a molecular weight of 329.42 g/mol, XLogP of 5.82, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-2-yl-4-thiophen-2-ylbenzamide is sourced from PubChem (CID 59673380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).