N-methyl-2-[1-(4-methylphenyl)cyclopentyl]acetamide

C15H21NO — CID 59020002

IUPACN-methyl-2-[1-(4-methylphenyl)cyclopentyl]acetamide
SMILESCNC(=O)CC1(c2ccc(C)cc2)CCCC1
InChIInChI=1S/C15H21NO/c1-12-5-7-13(8-6-12)15(9-3-4-10-15)11-14(17)16-2/h5-8H,3-4,9-11H2,1-2H3,(H,16,17)
InChIKeyNATPABQYSDMKCQ-UHFFFAOYSA-N
MW231.34 g/mol
LogP2.94
Rot. Bonds3

About N-methyl-2-[1-(4-methylphenyl)cyclopentyl]acetamide

N-methyl-2-[1-(4-methylphenyl)cyclopentyl]acetamide (PubChem CID 59020002) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is N-methyl-2-[1-(4-methylphenyl)cyclopentyl]acetamide.

Molecular Properties

Compound NameN-methyl-2-[1-(4-methylphenyl)cyclopentyl]acetamide
PubChem CID59020002
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC NameN-methyl-2-[1-(4-methylphenyl)cyclopentyl]acetamide
SMILESCNC(=O)CC1(c2ccc(C)cc2)CCCC1
InChIInChI=1S/C15H21NO/c1-12-5-7-13(8-6-12)15(9-3-4-10-15)11-14(17)16-2/h5-8H,3-4,9-11H2,1-2H3,(H,16,17)
InChIKeyNATPABQYSDMKCQ-UHFFFAOYSA-N
XLogP2.94
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[1-(4-methylphenyl)cyclopentyl]acetamide?
The IUPAC name of N-methyl-2-[1-(4-methylphenyl)cyclopentyl]acetamide (CID 59020002) is N-methyl-2-[1-(4-methylphenyl)cyclopentyl]acetamide.
What is the SMILES notation for N-methyl-2-[1-(4-methylphenyl)cyclopentyl]acetamide?
The canonical SMILES for N-methyl-2-[1-(4-methylphenyl)cyclopentyl]acetamide is CNC(=O)CC1(c2ccc(C)cc2)CCCC1.
What is the InChIKey of N-methyl-2-[1-(4-methylphenyl)cyclopentyl]acetamide?
The InChIKey is NATPABQYSDMKCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c1-12-5-7-13(8-6-12)15(9-3-4-10-15)11-14(17)16-2/h5-8H,3-4,9-11H2,1-2H3,(H,16,17).
What are the key properties of N-methyl-2-[1-(4-methylphenyl)cyclopentyl]acetamide?
N-methyl-2-[1-(4-methylphenyl)cyclopentyl]acetamide has a molecular weight of 231.34 g/mol, XLogP of 2.94, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[1-(4-methylphenyl)cyclopentyl]acetamide is sourced from PubChem (CID 59020002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).