N-methyl-N-(4-methylphenyl)cyclohexanecarboxamide

C15H21NO — CID 142999335

IUPACN-methyl-N-(4-methylphenyl)cyclohexanecarboxamide
SMILESCc1ccc(N(C)C(=O)C2CCCCC2)cc1
InChIInChI=1S/C15H21NO/c1-12-8-10-14(11-9-12)16(2)15(17)13-6-4-3-5-7-13/h8-11,13H,3-7H2,1-2H3
InChIKeyRLPIHDSOIPWELI-UHFFFAOYSA-N
MW231.34 g/mol
LogP3.54
Rot. Bonds2

About N-methyl-N-(4-methylphenyl)cyclohexanecarboxamide

N-methyl-N-(4-methylphenyl)cyclohexanecarboxamide (PubChem CID 142999335) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is N-methyl-N-(4-methylphenyl)cyclohexanecarboxamide.

Molecular Properties

Compound NameN-methyl-N-(4-methylphenyl)cyclohexanecarboxamide
PubChem CID142999335
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC NameN-methyl-N-(4-methylphenyl)cyclohexanecarboxamide
SMILESCc1ccc(N(C)C(=O)C2CCCCC2)cc1
InChIInChI=1S/C15H21NO/c1-12-8-10-14(11-9-12)16(2)15(17)13-6-4-3-5-7-13/h8-11,13H,3-7H2,1-2H3
InChIKeyRLPIHDSOIPWELI-UHFFFAOYSA-N
XLogP3.54
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(4-methylphenyl)cyclohexanecarboxamide?
The IUPAC name of N-methyl-N-(4-methylphenyl)cyclohexanecarboxamide (CID 142999335) is N-methyl-N-(4-methylphenyl)cyclohexanecarboxamide.
What is the SMILES notation for N-methyl-N-(4-methylphenyl)cyclohexanecarboxamide?
The canonical SMILES for N-methyl-N-(4-methylphenyl)cyclohexanecarboxamide is Cc1ccc(N(C)C(=O)C2CCCCC2)cc1.
What is the InChIKey of N-methyl-N-(4-methylphenyl)cyclohexanecarboxamide?
The InChIKey is RLPIHDSOIPWELI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c1-12-8-10-14(11-9-12)16(2)15(17)13-6-4-3-5-7-13/h8-11,13H,3-7H2,1-2H3.
What are the key properties of N-methyl-N-(4-methylphenyl)cyclohexanecarboxamide?
N-methyl-N-(4-methylphenyl)cyclohexanecarboxamide has a molecular weight of 231.34 g/mol, XLogP of 3.54, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(4-methylphenyl)cyclohexanecarboxamide is sourced from PubChem (CID 142999335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).