2-[acetyl(cyclohexyl)amino]-N-ethyl-N-(3-methylphenyl)acetamide

C19H28N2O2 — CID 113159596

IUPAC2-[acetyl(cyclohexyl)amino]-N-ethyl-N-(3-methylphenyl)acetamide
SMILESCCN(C(=O)CN(C(C)=O)C1CCCCC1)c1cccc(C)c1
InChIInChI=1S/C19H28N2O2/c1-4-20(18-12-8-9-15(2)13-18)19(23)14-21(16(3)22)17-10-6-5-7-11-17/h8-9,12-13,17H,4-7,10-11,14H2,1-3H3
InChIKeyCYOFZIVTMAFPCE-UHFFFAOYSA-N
MW316.44 g/mol
LogP3.53
Rot. Bonds5

About 2-[acetyl(cyclohexyl)amino]-N-ethyl-N-(3-methylphenyl)acetamide

2-[acetyl(cyclohexyl)amino]-N-ethyl-N-(3-methylphenyl)acetamide (PubChem CID 113159596) has the molecular formula C19H28N2O2 and a molecular weight of 316.44 g/mol. Its IUPAC name is 2-[acetyl(cyclohexyl)amino]-N-ethyl-N-(3-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[acetyl(cyclohexyl)amino]-N-ethyl-N-(3-methylphenyl)acetamide
PubChem CID113159596
Molecular FormulaC19H28N2O2
Molecular Weight316.44 g/mol
Exact Mass316.22
IUPAC Name2-[acetyl(cyclohexyl)amino]-N-ethyl-N-(3-methylphenyl)acetamide
SMILESCCN(C(=O)CN(C(C)=O)C1CCCCC1)c1cccc(C)c1
InChIInChI=1S/C19H28N2O2/c1-4-20(18-12-8-9-15(2)13-18)19(23)14-21(16(3)22)17-10-6-5-7-11-17/h8-9,12-13,17H,4-7,10-11,14H2,1-3H3
InChIKeyCYOFZIVTMAFPCE-UHFFFAOYSA-N
XLogP3.53
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.44
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(N-acetyl-3-methylanilino)-N-ethyl-N-(3-methylphenyl)acetamide
CID 113167645
N-cyclohexyl-N'-ethyl-N-methyl-N'-(3-methylphenyl)oxamide
CID 108503849
N-ethyl-N-(3-methylphenyl)cyclohexanecarboxamide
CID 533210
N-cyclopentyl-N'-ethyl-N'-(3-methylphenyl)propanediamide
CID 108942305
3-[cyclopentyl(methylsulfonyl)amino]-N-ethyl-N-(3-methylphenyl)propanamide
CID 113137357
2-[cyclopropyl-[ethyl-(3-methylphenyl)carbamoyl]amino]acetic acid
CID 61206742
N-cyclopropyl-N'-ethyl-N'-(3-methylphenyl)propanediamide
CID 108941153
2-(N-acetyl-3,4-dichloroanilino)-N-ethyl-N-(3-methylphenyl)acetamide
CID 113179532
2-[acetyl(3-methoxypropyl)amino]-N-ethyl-N-(3-methylphenyl)acetamide
CID 113160180
N-cyclohexyl-N-ethyl-3-methylaniline
CID 21396772
N-ethyl-3-(2-ethylpiperidin-1-yl)-N-(3-methylphenyl)-3-oxopropanamide
CID 108952293
N-ethyl-N-(3-methylphenyl)-3-piperidin-2-ylpropanamide
CID 62212541

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(cyclohexyl)amino]-N-ethyl-N-(3-methylphenyl)acetamide?
The IUPAC name of 2-[acetyl(cyclohexyl)amino]-N-ethyl-N-(3-methylphenyl)acetamide (CID 113159596) is 2-[acetyl(cyclohexyl)amino]-N-ethyl-N-(3-methylphenyl)acetamide.
What is the SMILES notation for 2-[acetyl(cyclohexyl)amino]-N-ethyl-N-(3-methylphenyl)acetamide?
The canonical SMILES for 2-[acetyl(cyclohexyl)amino]-N-ethyl-N-(3-methylphenyl)acetamide is CCN(C(=O)CN(C(C)=O)C1CCCCC1)c1cccc(C)c1.
What is the InChIKey of 2-[acetyl(cyclohexyl)amino]-N-ethyl-N-(3-methylphenyl)acetamide?
The InChIKey is CYOFZIVTMAFPCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O2/c1-4-20(18-12-8-9-15(2)13-18)19(23)14-21(16(3)22)17-10-6-5-7-11-17/h8-9,12-13,17H,4-7,10-11,14H2,1-3H3.
What are the key properties of 2-[acetyl(cyclohexyl)amino]-N-ethyl-N-(3-methylphenyl)acetamide?
2-[acetyl(cyclohexyl)amino]-N-ethyl-N-(3-methylphenyl)acetamide has a molecular weight of 316.44 g/mol, XLogP of 3.53, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(cyclohexyl)amino]-N-ethyl-N-(3-methylphenyl)acetamide is sourced from PubChem (CID 113159596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).