N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide

C17H19NO — CID 60737715

IUPACN-methyl-N-[1-(4-methylphenyl)ethyl]benzamide
SMILESCc1ccc(C(C)N(C)C(=O)c2ccccc2)cc1
InChIInChI=1S/C17H19NO/c1-13-9-11-15(12-10-13)14(2)18(3)17(19)16-7-5-4-6-8-16/h4-12,14H,1-3H3
InChIKeyTUYANZFAIGOLFJ-UHFFFAOYSA-N
MW253.34 g/mol
LogP3.83
Rot. Bonds3

About N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide

N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide (PubChem CID 60737715) has the molecular formula C17H19NO and a molecular weight of 253.34 g/mol. Its IUPAC name is N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide.

Molecular Properties

Compound NameN-methyl-N-[1-(4-methylphenyl)ethyl]benzamide
PubChem CID60737715
Molecular FormulaC17H19NO
Molecular Weight253.34 g/mol
Exact Mass253.15
IUPAC NameN-methyl-N-[1-(4-methylphenyl)ethyl]benzamide
SMILESCc1ccc(C(C)N(C)C(=O)c2ccccc2)cc1
InChIInChI=1S/C17H19NO/c1-13-9-11-15(12-10-13)14(2)18(3)17(19)16-7-5-4-6-8-16/h4-12,14H,1-3H3
InChIKeyTUYANZFAIGOLFJ-UHFFFAOYSA-N
XLogP3.83
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.34
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide?
The IUPAC name of N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide (CID 60737715) is N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide.
What is the SMILES notation for N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide?
The canonical SMILES for N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide is Cc1ccc(C(C)N(C)C(=O)c2ccccc2)cc1.
What is the InChIKey of N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide?
The InChIKey is TUYANZFAIGOLFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO/c1-13-9-11-15(12-10-13)14(2)18(3)17(19)16-7-5-4-6-8-16/h4-12,14H,1-3H3.
What are the key properties of N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide?
N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide has a molecular weight of 253.34 g/mol, XLogP of 3.83, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide is sourced from PubChem (CID 60737715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).