2-[(3-ethylcyclohexyl)amino]-N-(4-methylphenyl)acetamide

C17H26N2O — CID 64742801

IUPAC2-[(3-ethylcyclohexyl)amino]-N-(4-methylphenyl)acetamide
SMILESCCC1CCCC(NCC(=O)Nc2ccc(C)cc2)C1
InChIInChI=1S/C17H26N2O/c1-3-14-5-4-6-16(11-14)18-12-17(20)19-15-9-7-13(2)8-10-15/h7-10,14,16,18H,3-6,11-12H2,1-2H3,(H,19,20)
InChIKeyACNLKNOHUIBSCJ-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.49
Rot. Bonds5

About 2-[(3-ethylcyclohexyl)amino]-N-(4-methylphenyl)acetamide

2-[(3-ethylcyclohexyl)amino]-N-(4-methylphenyl)acetamide (PubChem CID 64742801) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 2-[(3-ethylcyclohexyl)amino]-N-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[(3-ethylcyclohexyl)amino]-N-(4-methylphenyl)acetamide
PubChem CID64742801
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name2-[(3-ethylcyclohexyl)amino]-N-(4-methylphenyl)acetamide
SMILESCCC1CCCC(NCC(=O)Nc2ccc(C)cc2)C1
InChIInChI=1S/C17H26N2O/c1-3-14-5-4-6-16(11-14)18-12-17(20)19-15-9-7-13(2)8-10-15/h7-10,14,16,18H,3-6,11-12H2,1-2H3,(H,19,20)
InChIKeyACNLKNOHUIBSCJ-UHFFFAOYSA-N
XLogP3.49
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(3-ethylcyclohexyl)amino]-N-(3-methylphenyl)acetamide
CID 64742409
N-(2-bromophenyl)-2-[(3-ethylcyclohexyl)amino]acetamide
CID 64743584
2-[3-[2-(4-methylanilino)-2-oxoethyl]cyclohexyl]-N-(4-methylphenyl)acetamide
CID 58862999
N-cyclohexyl-2-[(3-ethylcyclohexyl)amino]acetamide
CID 64742794
2-[(4-methylcyclohexyl)amino]-N-(4-methylphenyl)acetamide
CID 28579743
2-[(4-ethylcyclohexyl)amino]-N-phenylacetamide
CID 60958245
N-(4-methylphenyl)-2-(oxolan-3-ylamino)acetamide
CID 80713616
2-(cyclopentylamino)-N-(4-ethoxyphenyl)acetamide
CID 47107212
2-(cyclopentylamino)-N-(4-hydroxyphenyl)acetamide
CID 54918004
N-(4-methylphenyl)-2-[(1-propylpiperidin-4-yl)amino]acetamide
CID 60695712
2-[(2-methylcyclohexyl)amino]-N-(4-methylphenyl)acetamide
CID 43179972
2-(cyclopropylmethylamino)-N-(4-methylphenyl)acetamide
CID 28566911

Frequently Asked Questions

What is the IUPAC name of 2-[(3-ethylcyclohexyl)amino]-N-(4-methylphenyl)acetamide?
The IUPAC name of 2-[(3-ethylcyclohexyl)amino]-N-(4-methylphenyl)acetamide (CID 64742801) is 2-[(3-ethylcyclohexyl)amino]-N-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-[(3-ethylcyclohexyl)amino]-N-(4-methylphenyl)acetamide?
The canonical SMILES for 2-[(3-ethylcyclohexyl)amino]-N-(4-methylphenyl)acetamide is CCC1CCCC(NCC(=O)Nc2ccc(C)cc2)C1.
What is the InChIKey of 2-[(3-ethylcyclohexyl)amino]-N-(4-methylphenyl)acetamide?
The InChIKey is ACNLKNOHUIBSCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-3-14-5-4-6-16(11-14)18-12-17(20)19-15-9-7-13(2)8-10-15/h7-10,14,16,18H,3-6,11-12H2,1-2H3,(H,19,20).
What are the key properties of 2-[(3-ethylcyclohexyl)amino]-N-(4-methylphenyl)acetamide?
2-[(3-ethylcyclohexyl)amino]-N-(4-methylphenyl)acetamide has a molecular weight of 274.41 g/mol, XLogP of 3.49, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-ethylcyclohexyl)amino]-N-(4-methylphenyl)acetamide is sourced from PubChem (CID 64742801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).