2,3-dimethyl-N-(2-phenylpropan-2-yl)benzamide

C18H21NO — CID 47444747

IUPAC2,3-dimethyl-N-(2-phenylpropan-2-yl)benzamide
SMILESCc1cccc(C(=O)NC(C)(C)c2ccccc2)c1C
InChIInChI=1S/C18H21NO/c1-13-9-8-12-16(14(13)2)17(20)19-18(3,4)15-10-6-5-7-11-15/h5-12H,1-4H3,(H,19,20)
InChIKeyYONFBIOXQAZXMJ-UHFFFAOYSA-N
MW267.37 g/mol
LogP3.97
Rot. Bonds3

About 2,3-dimethyl-N-(2-phenylpropan-2-yl)benzamide

2,3-dimethyl-N-(2-phenylpropan-2-yl)benzamide (PubChem CID 47444747) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is 2,3-dimethyl-N-(2-phenylpropan-2-yl)benzamide.

Molecular Properties

Compound Name2,3-dimethyl-N-(2-phenylpropan-2-yl)benzamide
PubChem CID47444747
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC Name2,3-dimethyl-N-(2-phenylpropan-2-yl)benzamide
SMILESCc1cccc(C(=O)NC(C)(C)c2ccccc2)c1C
InChIInChI=1S/C18H21NO/c1-13-9-8-12-16(14(13)2)17(20)19-18(3,4)15-10-6-5-7-11-15/h5-12H,1-4H3,(H,19,20)
InChIKeyYONFBIOXQAZXMJ-UHFFFAOYSA-N
XLogP3.97
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(1-hydroxy-2-phenylpropan-2-yl)-2,3-dimethylbenzamide
CID 105058775
N-(3-hydroxy-2-methylbutan-2-yl)-2,3-dimethylbenzamide
CID 113346953
2-iodo-N-(2-phenylpropan-2-yl)benzamide
CID 47444713
2-(4-methylphenyl)-N-(2-phenylpropan-2-yl)benzamide
CID 101062971
2-phenylpropan-2-ylcarbamic acid
CID 23445609
N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]-2,3-dimethylbenzamide
CID 113346912
ethane;N,2,3-trimethylbenzamide
CID 178108869
2,3-dimethylbenzohydrazide
CID 16790549
2,6-dimethoxy-N-(2-phenylpropan-2-yl)benzamide
CID 113091730
3-[(2,3-dimethylbenzoyl)amino]-2-hydroxy-2-methylpropanoic acid
CID 66172550
2-chloro-N-(1-chloro-2-phenylpropan-2-yl)-3-methylbenzamide
CID 105059808
2-bromo-N-(1-chloro-2-phenylpropan-2-yl)-3-methylbenzamide
CID 107984063

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-N-(2-phenylpropan-2-yl)benzamide?
The IUPAC name of 2,3-dimethyl-N-(2-phenylpropan-2-yl)benzamide (CID 47444747) is 2,3-dimethyl-N-(2-phenylpropan-2-yl)benzamide.
What is the SMILES notation for 2,3-dimethyl-N-(2-phenylpropan-2-yl)benzamide?
The canonical SMILES for 2,3-dimethyl-N-(2-phenylpropan-2-yl)benzamide is Cc1cccc(C(=O)NC(C)(C)c2ccccc2)c1C.
What is the InChIKey of 2,3-dimethyl-N-(2-phenylpropan-2-yl)benzamide?
The InChIKey is YONFBIOXQAZXMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-13-9-8-12-16(14(13)2)17(20)19-18(3,4)15-10-6-5-7-11-15/h5-12H,1-4H3,(H,19,20).
What are the key properties of 2,3-dimethyl-N-(2-phenylpropan-2-yl)benzamide?
2,3-dimethyl-N-(2-phenylpropan-2-yl)benzamide has a molecular weight of 267.37 g/mol, XLogP of 3.97, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-N-(2-phenylpropan-2-yl)benzamide is sourced from PubChem (CID 47444747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).