2-(cyclohexylcarbamoylamino)-N-(2-ethoxyphenyl)acetamide

C17H25N3O3 — CID 112998805

IUPAC2-(cyclohexylcarbamoylamino)-N-(2-ethoxyphenyl)acetamide
SMILESCCOc1ccccc1NC(=O)CNC(=O)NC1CCCCC1
InChIInChI=1S/C17H25N3O3/c1-2-23-15-11-7-6-10-14(15)20-16(21)12-18-17(22)19-13-8-4-3-5-9-13/h6-7,10-11,13H,2-5,8-9,12H2,1H3,(H,20,21)(H2,18,19,22)
InChIKeySIVVUCNPVFFISO-UHFFFAOYSA-N
MW319.40 g/mol
LogP2.66
Rot. Bonds6

About 2-(cyclohexylcarbamoylamino)-N-(2-ethoxyphenyl)acetamide

2-(cyclohexylcarbamoylamino)-N-(2-ethoxyphenyl)acetamide (PubChem CID 112998805) has the molecular formula C17H25N3O3 and a molecular weight of 319.40 g/mol. Its IUPAC name is 2-(cyclohexylcarbamoylamino)-N-(2-ethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(cyclohexylcarbamoylamino)-N-(2-ethoxyphenyl)acetamide
PubChem CID112998805
Molecular FormulaC17H25N3O3
Molecular Weight319.40 g/mol
Exact Mass319.19
IUPAC Name2-(cyclohexylcarbamoylamino)-N-(2-ethoxyphenyl)acetamide
SMILESCCOc1ccccc1NC(=O)CNC(=O)NC1CCCCC1
InChIInChI=1S/C17H25N3O3/c1-2-23-15-11-7-6-10-14(15)20-16(21)12-18-17(22)19-13-8-4-3-5-9-13/h6-7,10-11,13H,2-5,8-9,12H2,1H3,(H,20,21)(H2,18,19,22)
InChIKeySIVVUCNPVFFISO-UHFFFAOYSA-N
XLogP2.66
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.40
LogP ≤ 52.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 2-[[2-(cyclohexylcarbamoylamino)acetyl]amino]benzoate
CID 113001757
N-cyclohexyl-N'-(2-ethoxyphenyl)oxamide
CID 7585382
N-(2-ethoxyphenyl)-2-(propan-2-ylcarbamoylamino)acetamide
CID 112998813
2-(cyclohexylcarbamoylamino)-N-(2,3-dimethylphenyl)acetamide
CID 51179268
2-(cyclopropylcarbamoylamino)-N-(2-phenoxyphenyl)acetamide
CID 113000974
1-cyclohexyl-3-(2-propoxyphenyl)urea
CID 47103328
1-cycloheptyl-3-(2-ethoxyphenyl)thiourea
CID 19650473
2-N-cyclopentyl-1-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109132110
[2-(cyclopropylamino)-2-oxoethyl]-[2-(2-ethoxyanilino)-2-oxoethyl]-methylazanium
CID 9052823
N-cyclohexyl-2-(2-ethoxyphenoxy)acetamide
CID 731871
2-(cyclohexylcarbamoylamino)-N-(2,4-dimethylphenyl)acetamide
CID 112996389
methyl 2-[[2-(cyclopropylcarbamoylamino)acetyl]amino]benzoate
CID 112999833

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylcarbamoylamino)-N-(2-ethoxyphenyl)acetamide?
The IUPAC name of 2-(cyclohexylcarbamoylamino)-N-(2-ethoxyphenyl)acetamide (CID 112998805) is 2-(cyclohexylcarbamoylamino)-N-(2-ethoxyphenyl)acetamide.
What is the SMILES notation for 2-(cyclohexylcarbamoylamino)-N-(2-ethoxyphenyl)acetamide?
The canonical SMILES for 2-(cyclohexylcarbamoylamino)-N-(2-ethoxyphenyl)acetamide is CCOc1ccccc1NC(=O)CNC(=O)NC1CCCCC1.
What is the InChIKey of 2-(cyclohexylcarbamoylamino)-N-(2-ethoxyphenyl)acetamide?
The InChIKey is SIVVUCNPVFFISO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O3/c1-2-23-15-11-7-6-10-14(15)20-16(21)12-18-17(22)19-13-8-4-3-5-9-13/h6-7,10-11,13H,2-5,8-9,12H2,1H3,(H,20,21)(H2,18,19,22).
What are the key properties of 2-(cyclohexylcarbamoylamino)-N-(2-ethoxyphenyl)acetamide?
2-(cyclohexylcarbamoylamino)-N-(2-ethoxyphenyl)acetamide has a molecular weight of 319.40 g/mol, XLogP of 2.66, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylcarbamoylamino)-N-(2-ethoxyphenyl)acetamide is sourced from PubChem (CID 112998805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).