2-[(3-methylcyclopentyl)methylamino]-N-(2-methylphenyl)acetamide

C16H24N2O — CID 107412858

IUPAC2-[(3-methylcyclopentyl)methylamino]-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)CNCC1CCC(C)C1
InChIInChI=1S/C16H24N2O/c1-12-7-8-14(9-12)10-17-11-16(19)18-15-6-4-3-5-13(15)2/h3-6,12,14,17H,7-11H2,1-2H3,(H,18,19)
InChIKeyDSACHALLKLMEBZ-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.96
Rot. Bonds5

About 2-[(3-methylcyclopentyl)methylamino]-N-(2-methylphenyl)acetamide

2-[(3-methylcyclopentyl)methylamino]-N-(2-methylphenyl)acetamide (PubChem CID 107412858) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-[(3-methylcyclopentyl)methylamino]-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[(3-methylcyclopentyl)methylamino]-N-(2-methylphenyl)acetamide
PubChem CID107412858
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-[(3-methylcyclopentyl)methylamino]-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)CNCC1CCC(C)C1
InChIInChI=1S/C16H24N2O/c1-12-7-8-14(9-12)10-17-11-16(19)18-15-6-4-3-5-13(15)2/h3-6,12,14,17H,7-11H2,1-2H3,(H,18,19)
InChIKeyDSACHALLKLMEBZ-UHFFFAOYSA-N
XLogP2.96
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(3-methylcyclopentyl)methylamino]-N-(2-methylphenyl)acetamide?
The IUPAC name of 2-[(3-methylcyclopentyl)methylamino]-N-(2-methylphenyl)acetamide (CID 107412858) is 2-[(3-methylcyclopentyl)methylamino]-N-(2-methylphenyl)acetamide.
What is the SMILES notation for 2-[(3-methylcyclopentyl)methylamino]-N-(2-methylphenyl)acetamide?
The canonical SMILES for 2-[(3-methylcyclopentyl)methylamino]-N-(2-methylphenyl)acetamide is Cc1ccccc1NC(=O)CNCC1CCC(C)C1.
What is the InChIKey of 2-[(3-methylcyclopentyl)methylamino]-N-(2-methylphenyl)acetamide?
The InChIKey is DSACHALLKLMEBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-12-7-8-14(9-12)10-17-11-16(19)18-15-6-4-3-5-13(15)2/h3-6,12,14,17H,7-11H2,1-2H3,(H,18,19).
What are the key properties of 2-[(3-methylcyclopentyl)methylamino]-N-(2-methylphenyl)acetamide?
2-[(3-methylcyclopentyl)methylamino]-N-(2-methylphenyl)acetamide has a molecular weight of 260.38 g/mol, XLogP of 2.96, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methylcyclopentyl)methylamino]-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 107412858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).