N,2-dimethyl-N-(5-phenylthiophen-3-yl)benzamide

C19H17NOS — CID 67299056

IUPACN,2-dimethyl-N-(5-phenylthiophen-3-yl)benzamide
SMILESCc1ccccc1C(=O)N(C)c1csc(-c2ccccc2)c1
InChIInChI=1S/C19H17NOS/c1-14-8-6-7-11-17(14)19(21)20(2)16-12-18(22-13-16)15-9-4-3-5-10-15/h3-13H,1-2H3
InChIKeyXKAPQHMSSQQCSD-UHFFFAOYSA-N
MW307.42 g/mol
LogP5.00
Rot. Bonds3

About N,2-dimethyl-N-(5-phenylthiophen-3-yl)benzamide

N,2-dimethyl-N-(5-phenylthiophen-3-yl)benzamide (PubChem CID 67299056) has the molecular formula C19H17NOS and a molecular weight of 307.42 g/mol. Its IUPAC name is N,2-dimethyl-N-(5-phenylthiophen-3-yl)benzamide.

Molecular Properties

Compound NameN,2-dimethyl-N-(5-phenylthiophen-3-yl)benzamide
PubChem CID67299056
Molecular FormulaC19H17NOS
Molecular Weight307.42 g/mol
Exact Mass307.10
IUPAC NameN,2-dimethyl-N-(5-phenylthiophen-3-yl)benzamide
SMILESCc1ccccc1C(=O)N(C)c1csc(-c2ccccc2)c1
InChIInChI=1S/C19H17NOS/c1-14-8-6-7-11-17(14)19(21)20(2)16-12-18(22-13-16)15-9-4-3-5-10-15/h3-13H,1-2H3
InChIKeyXKAPQHMSSQQCSD-UHFFFAOYSA-N
XLogP5.00
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500307.42
LogP ≤ 55.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,2-dimethyl-N-phenylbenzamide
CID 5222383
N,2-dimethyl-N-(3-methylphenyl)benzamide;ethane
CID 91376275
N,2-dimethyl-N-(4-methylphenyl)benzamide
CID 58207098
N,2-dimethyl-N-(2-methylphenyl)benzamide
CID 71395326
N-(4-cyanophenyl)-N,2-dimethylbenzamide
CID 62982757
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N,2-dimethylbenzamide
CID 110752792
N-[4-[(dipropylamino)methyl]phenyl]-N,2-dimethylbenzamide
CID 151032584
N-(4-carbamothioylphenyl)-N,2-dimethylbenzamide
CID 62969603
N,2-dimethyl-N-[2-[methyl-[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]benzamide
CID 118041352
N-chloro-N,2-dimethylbenzamide
CID 166437996
N-iodo-N,2-dimethylbenzamide
CID 143099347
N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-N,2-dimethylbenzamide
CID 857526

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-(5-phenylthiophen-3-yl)benzamide?
The IUPAC name of N,2-dimethyl-N-(5-phenylthiophen-3-yl)benzamide (CID 67299056) is N,2-dimethyl-N-(5-phenylthiophen-3-yl)benzamide.
What is the SMILES notation for N,2-dimethyl-N-(5-phenylthiophen-3-yl)benzamide?
The canonical SMILES for N,2-dimethyl-N-(5-phenylthiophen-3-yl)benzamide is Cc1ccccc1C(=O)N(C)c1csc(-c2ccccc2)c1.
What is the InChIKey of N,2-dimethyl-N-(5-phenylthiophen-3-yl)benzamide?
The InChIKey is XKAPQHMSSQQCSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NOS/c1-14-8-6-7-11-17(14)19(21)20(2)16-12-18(22-13-16)15-9-4-3-5-10-15/h3-13H,1-2H3.
What are the key properties of N,2-dimethyl-N-(5-phenylthiophen-3-yl)benzamide?
N,2-dimethyl-N-(5-phenylthiophen-3-yl)benzamide has a molecular weight of 307.42 g/mol, XLogP of 5.00, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-(5-phenylthiophen-3-yl)benzamide is sourced from PubChem (CID 67299056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).