N-benzyl-2-(2-methylphenyl)-N-propan-2-ylacetamide

C19H23NO — CID 113098358

IUPACN-benzyl-2-(2-methylphenyl)-N-propan-2-ylacetamide
SMILESCc1ccccc1CC(=O)N(Cc1ccccc1)C(C)C
InChIInChI=1S/C19H23NO/c1-15(2)20(14-17-10-5-4-6-11-17)19(21)13-18-12-8-7-9-16(18)3/h4-12,15H,13-14H2,1-3H3
InChIKeyWLNURSQIHWCRJT-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.97
Rot. Bonds5

About N-benzyl-2-(2-methylphenyl)-N-propan-2-ylacetamide

N-benzyl-2-(2-methylphenyl)-N-propan-2-ylacetamide (PubChem CID 113098358) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is N-benzyl-2-(2-methylphenyl)-N-propan-2-ylacetamide.

Molecular Properties

Compound NameN-benzyl-2-(2-methylphenyl)-N-propan-2-ylacetamide
PubChem CID113098358
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC NameN-benzyl-2-(2-methylphenyl)-N-propan-2-ylacetamide
SMILESCc1ccccc1CC(=O)N(Cc1ccccc1)C(C)C
InChIInChI=1S/C19H23NO/c1-15(2)20(14-17-10-5-4-6-11-17)19(21)13-18-12-8-7-9-16(18)3/h4-12,15H,13-14H2,1-3H3
InChIKeyWLNURSQIHWCRJT-UHFFFAOYSA-N
XLogP3.97
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[benzyl-[2-(2-methylphenyl)acetyl]amino]-N-propan-2-ylbutanamide
CID 132654865
(2S)-2-[benzyl-[2-(2-methylphenyl)acetyl]amino]-N-butyl-3-phenylpropanamide
CID 100585388
N-benzyl-2-methyl-N-propan-2-ylbenzamide
CID 562391
ethyl 2-[[2-(2-methylphenyl)acetyl]-propan-2-ylamino]acetate
CID 61021189
N-benzyl-4-methyl-N-propan-2-ylpentanamide
CID 86978961
N-benzyl-3-(2-methylanilino)-N-propan-2-ylpropanamide
CID 109031682
(2R)-2-[(4-bromophenyl)methyl-[2-(2-methylphenyl)acetyl]amino]-3-phenyl-N-propan-2-ylpropanamide
CID 100528777
N-benzyl-N-propan-2-yl-2-(1H-pyrrol-3-yl)acetamide
CID 110769169
(2S)-2-[(4-chlorophenyl)methyl-[2-(2-methylphenyl)acetyl]amino]-3-phenyl-N-propan-2-ylpropanamide
CID 100506714
2-[benzyl-[2-(2-methylphenyl)acetyl]amino]-N-cyclopentyl-3-phenylpropanamide
CID 133263659
(2R)-2-[[2-(2-methylphenyl)acetyl]-[(2-methylphenyl)methyl]amino]-N-(2-methylpropyl)-3-phenylpropanamide
CID 100745793
2-[benzyl-[2-(2,5-dimethylphenyl)acetyl]amino]-N-propan-2-ylpropanamide
CID 132654863

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(2-methylphenyl)-N-propan-2-ylacetamide?
The IUPAC name of N-benzyl-2-(2-methylphenyl)-N-propan-2-ylacetamide (CID 113098358) is N-benzyl-2-(2-methylphenyl)-N-propan-2-ylacetamide.
What is the SMILES notation for N-benzyl-2-(2-methylphenyl)-N-propan-2-ylacetamide?
The canonical SMILES for N-benzyl-2-(2-methylphenyl)-N-propan-2-ylacetamide is Cc1ccccc1CC(=O)N(Cc1ccccc1)C(C)C.
What is the InChIKey of N-benzyl-2-(2-methylphenyl)-N-propan-2-ylacetamide?
The InChIKey is WLNURSQIHWCRJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-15(2)20(14-17-10-5-4-6-11-17)19(21)13-18-12-8-7-9-16(18)3/h4-12,15H,13-14H2,1-3H3.
What are the key properties of N-benzyl-2-(2-methylphenyl)-N-propan-2-ylacetamide?
N-benzyl-2-(2-methylphenyl)-N-propan-2-ylacetamide has a molecular weight of 281.40 g/mol, XLogP of 3.97, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(2-methylphenyl)-N-propan-2-ylacetamide is sourced from PubChem (CID 113098358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).