2-[(4-ethylcyclohexyl)amino]-N-phenylacetamide

C16H24N2O — CID 60958245

IUPAC2-[(4-ethylcyclohexyl)amino]-N-phenylacetamide
SMILESCCC1CCC(NCC(=O)Nc2ccccc2)CC1
InChIInChI=1S/C16H24N2O/c1-2-13-8-10-14(11-9-13)17-12-16(19)18-15-6-4-3-5-7-15/h3-7,13-14,17H,2,8-12H2,1H3,(H,18,19)
InChIKeyZNIGZVMHHVJQMY-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.18
Rot. Bonds5

About 2-[(4-ethylcyclohexyl)amino]-N-phenylacetamide

2-[(4-ethylcyclohexyl)amino]-N-phenylacetamide (PubChem CID 60958245) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-[(4-ethylcyclohexyl)amino]-N-phenylacetamide.

Molecular Properties

Compound Name2-[(4-ethylcyclohexyl)amino]-N-phenylacetamide
PubChem CID60958245
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-[(4-ethylcyclohexyl)amino]-N-phenylacetamide
SMILESCCC1CCC(NCC(=O)Nc2ccccc2)CC1
InChIInChI=1S/C16H24N2O/c1-2-13-8-10-14(11-9-13)17-12-16(19)18-15-6-4-3-5-7-15/h3-7,13-14,17H,2,8-12H2,1H3,(H,18,19)
InChIKeyZNIGZVMHHVJQMY-UHFFFAOYSA-N
XLogP3.18
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 ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-ethylcyclohexyl)amino]-N-phenylacetamide?
The IUPAC name of 2-[(4-ethylcyclohexyl)amino]-N-phenylacetamide (CID 60958245) is 2-[(4-ethylcyclohexyl)amino]-N-phenylacetamide.
What is the SMILES notation for 2-[(4-ethylcyclohexyl)amino]-N-phenylacetamide?
The canonical SMILES for 2-[(4-ethylcyclohexyl)amino]-N-phenylacetamide is CCC1CCC(NCC(=O)Nc2ccccc2)CC1.
What is the InChIKey of 2-[(4-ethylcyclohexyl)amino]-N-phenylacetamide?
The InChIKey is ZNIGZVMHHVJQMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-2-13-8-10-14(11-9-13)17-12-16(19)18-15-6-4-3-5-7-15/h3-7,13-14,17H,2,8-12H2,1H3,(H,18,19).
What are the key properties of 2-[(4-ethylcyclohexyl)amino]-N-phenylacetamide?
2-[(4-ethylcyclohexyl)amino]-N-phenylacetamide has a molecular weight of 260.38 g/mol, XLogP of 3.18, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-ethylcyclohexyl)amino]-N-phenylacetamide is sourced from PubChem (CID 60958245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).