2-(4-methylthiophen-2-yl)-N-(2-pyridin-2-ylpropan-2-yl)benzamide

C20H20N2OS — CID 122380196

IUPAC2-(4-methylthiophen-2-yl)-N-(2-pyridin-2-ylpropan-2-yl)benzamide
SMILESCc1csc(-c2ccccc2C(=O)NC(C)(C)c2ccccn2)c1
InChIInChI=1S/C20H20N2OS/c1-14-12-17(24-13-14)15-8-4-5-9-16(15)19(23)22-20(2,3)18-10-6-7-11-21-18/h4-13H,1-3H3,(H,22,23)
InChIKeyMPNSBNHRRBIYSN-UHFFFAOYSA-N
MW336.46 g/mol
LogP4.78
Rot. Bonds4

About 2-(4-methylthiophen-2-yl)-N-(2-pyridin-2-ylpropan-2-yl)benzamide

2-(4-methylthiophen-2-yl)-N-(2-pyridin-2-ylpropan-2-yl)benzamide (PubChem CID 122380196) has the molecular formula C20H20N2OS and a molecular weight of 336.46 g/mol. Its IUPAC name is 2-(4-methylthiophen-2-yl)-N-(2-pyridin-2-ylpropan-2-yl)benzamide.

Molecular Properties

Compound Name2-(4-methylthiophen-2-yl)-N-(2-pyridin-2-ylpropan-2-yl)benzamide
PubChem CID122380196
Molecular FormulaC20H20N2OS
Molecular Weight336.46 g/mol
Exact Mass336.13
IUPAC Name2-(4-methylthiophen-2-yl)-N-(2-pyridin-2-ylpropan-2-yl)benzamide
SMILESCc1csc(-c2ccccc2C(=O)NC(C)(C)c2ccccn2)c1
InChIInChI=1S/C20H20N2OS/c1-14-12-17(24-13-14)15-8-4-5-9-16(15)19(23)22-20(2,3)18-10-6-7-11-21-18/h4-13H,1-3H3,(H,22,23)
InChIKeyMPNSBNHRRBIYSN-UHFFFAOYSA-N
XLogP4.78
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.46
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-iodo-2-(5-methylthiophen-2-yl)-N-(2-pyridin-2-ylpropan-2-yl)benzamide
CID 166442652
N-(2-pyridin-2-ylpropan-2-yl)thiophene-2-carboxamide
CID 110870459
2-(4-methylphenyl)-N-(2-pyridin-2-ylpropan-2-yl)acetamide
CID 113091918
N-(2-pyridin-2-ylpropan-2-yl)pyridine-4-carboxamide
CID 110870482
2,4-dimethoxy-N-(2-pyridin-2-ylpropan-2-yl)benzamide
CID 135066856
2,6-dimethyl-4-propan-2-yl-N-(2-pyridin-2-ylpropan-2-yl)benzamide
CID 132505720
4-iodo-N-(2-pyridin-2-ylpropan-2-yl)benzamide
CID 166438575
2,6-di(propan-2-yl)-N-(2-pyridin-2-ylpropan-2-yl)benzamide
CID 87976563
2-(4-methylphenyl)-N-(2-phenylpropan-2-yl)benzamide
CID 101062971
3-chloro-2,2-dimethyl-N-(2-pyridin-2-ylpropan-2-yl)propanamide
CID 82108663
4-[(E)-3-(3,5-dichlorophenyl)-4,4,4-trifluorobut-1-enyl]-2-methyl-N-(2-pyridin-2-ylpropan-2-yl)benzamide
CID 89309694
N-(2-pyridin-2-ylpropan-2-yl)pentalene-1-carboxamide
CID 141292841

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylthiophen-2-yl)-N-(2-pyridin-2-ylpropan-2-yl)benzamide?
The IUPAC name of 2-(4-methylthiophen-2-yl)-N-(2-pyridin-2-ylpropan-2-yl)benzamide (CID 122380196) is 2-(4-methylthiophen-2-yl)-N-(2-pyridin-2-ylpropan-2-yl)benzamide.
What is the SMILES notation for 2-(4-methylthiophen-2-yl)-N-(2-pyridin-2-ylpropan-2-yl)benzamide?
The canonical SMILES for 2-(4-methylthiophen-2-yl)-N-(2-pyridin-2-ylpropan-2-yl)benzamide is Cc1csc(-c2ccccc2C(=O)NC(C)(C)c2ccccn2)c1.
What is the InChIKey of 2-(4-methylthiophen-2-yl)-N-(2-pyridin-2-ylpropan-2-yl)benzamide?
The InChIKey is MPNSBNHRRBIYSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2OS/c1-14-12-17(24-13-14)15-8-4-5-9-16(15)19(23)22-20(2,3)18-10-6-7-11-21-18/h4-13H,1-3H3,(H,22,23).
What are the key properties of 2-(4-methylthiophen-2-yl)-N-(2-pyridin-2-ylpropan-2-yl)benzamide?
2-(4-methylthiophen-2-yl)-N-(2-pyridin-2-ylpropan-2-yl)benzamide has a molecular weight of 336.46 g/mol, XLogP of 4.78, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylthiophen-2-yl)-N-(2-pyridin-2-ylpropan-2-yl)benzamide is sourced from PubChem (CID 122380196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).