2-[cycloheptyl(methyl)amino]-N-[1-(4-ethylphenyl)ethyl]acetamide

C20H32N2O — CID 18291170

IUPAC2-[cycloheptyl(methyl)amino]-N-[1-(4-ethylphenyl)ethyl]acetamide
SMILESCCc1ccc(C(C)NC(=O)CN(C)C2CCCCCC2)cc1
InChIInChI=1S/C20H32N2O/c1-4-17-11-13-18(14-12-17)16(2)21-20(23)15-22(3)19-9-7-5-6-8-10-19/h11-14,16,19H,4-10,15H2,1-3H3,(H,21,23)
InChIKeyLLNGLXKMJAYHBK-UHFFFAOYSA-N
MW316.49 g/mol
LogP4.08
Rot. Bonds6

About 2-[cycloheptyl(methyl)amino]-N-[1-(4-ethylphenyl)ethyl]acetamide

2-[cycloheptyl(methyl)amino]-N-[1-(4-ethylphenyl)ethyl]acetamide (PubChem CID 18291170) has the molecular formula C20H32N2O and a molecular weight of 316.49 g/mol. Its IUPAC name is 2-[cycloheptyl(methyl)amino]-N-[1-(4-ethylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-[cycloheptyl(methyl)amino]-N-[1-(4-ethylphenyl)ethyl]acetamide
PubChem CID18291170
Molecular FormulaC20H32N2O
Molecular Weight316.49 g/mol
Exact Mass316.25
IUPAC Name2-[cycloheptyl(methyl)amino]-N-[1-(4-ethylphenyl)ethyl]acetamide
SMILESCCc1ccc(C(C)NC(=O)CN(C)C2CCCCCC2)cc1
InChIInChI=1S/C20H32N2O/c1-4-17-11-13-18(14-12-17)16(2)21-20(23)15-22(3)19-9-7-5-6-8-10-19/h11-14,16,19H,4-10,15H2,1-3H3,(H,21,23)
InChIKeyLLNGLXKMJAYHBK-UHFFFAOYSA-N
XLogP4.08
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.49
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[cycloheptyl(methyl)amino]-N-[1-(4-ethylphenyl)ethyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-(4-chlorophenyl)ethyl]-2-[cycloheptyl(methyl)amino]acetamide
CID 55469245
2-[cyclohexyl(methyl)amino]-N-[(1R)-1-phenylethyl]acetamide
CID 8004439
2-[cyclohexyl(methyl)amino]-N-[1-(3,4-dichlorophenyl)ethyl]acetamide
CID 42913403
2-[azepan-4-yl(methyl)amino]-N-(1-phenylethyl)acetamide
CID 104979577
3-(cyclohexylcarbamoylamino)-N-[(1R)-1-(4-ethylphenyl)ethyl]propanamide
CID 25469560
3-(cyclohexylcarbamoylamino)-N-[(1S)-1-(4-ethylphenyl)ethyl]propanamide
CID 25469562
1-cyclopentyl-3-[1-(4-ethylphenyl)ethyl]urea
CID 47128258
N'-cyclopentyl-N-[1-(4-ethylphenyl)ethyl]-N'-methylethane-1,2-diamine
CID 63314482
2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-N-[1-(4-ethylphenyl)ethyl]acetamide
CID 51226406
1-(cyclohexylmethyl)-3-[1-(4-ethylphenyl)ethyl]urea
CID 108902838
2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide
CID 27107976
N-[1-(4-ethylphenyl)ethyl]-2-[(2-hydroxy-2-methylpropyl)-methylamino]acetamide
CID 111336392

Frequently Asked Questions

What is the IUPAC name of 2-[cycloheptyl(methyl)amino]-N-[1-(4-ethylphenyl)ethyl]acetamide?
The IUPAC name of 2-[cycloheptyl(methyl)amino]-N-[1-(4-ethylphenyl)ethyl]acetamide (CID 18291170) is 2-[cycloheptyl(methyl)amino]-N-[1-(4-ethylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-[cycloheptyl(methyl)amino]-N-[1-(4-ethylphenyl)ethyl]acetamide?
The canonical SMILES for 2-[cycloheptyl(methyl)amino]-N-[1-(4-ethylphenyl)ethyl]acetamide is CCc1ccc(C(C)NC(=O)CN(C)C2CCCCCC2)cc1.
What is the InChIKey of 2-[cycloheptyl(methyl)amino]-N-[1-(4-ethylphenyl)ethyl]acetamide?
The InChIKey is LLNGLXKMJAYHBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2O/c1-4-17-11-13-18(14-12-17)16(2)21-20(23)15-22(3)19-9-7-5-6-8-10-19/h11-14,16,19H,4-10,15H2,1-3H3,(H,21,23).
What are the key properties of 2-[cycloheptyl(methyl)amino]-N-[1-(4-ethylphenyl)ethyl]acetamide?
2-[cycloheptyl(methyl)amino]-N-[1-(4-ethylphenyl)ethyl]acetamide has a molecular weight of 316.49 g/mol, XLogP of 4.08, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cycloheptyl(methyl)amino]-N-[1-(4-ethylphenyl)ethyl]acetamide is sourced from PubChem (CID 18291170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).