2-(cyclohexylcarbamoylamino)-N-(2,4-dimethylphenyl)acetamide

C17H25N3O2 — CID 112996389

IUPAC2-(cyclohexylcarbamoylamino)-N-(2,4-dimethylphenyl)acetamide
SMILESCc1ccc(NC(=O)CNC(=O)NC2CCCCC2)c(C)c1
InChIInChI=1S/C17H25N3O2/c1-12-8-9-15(13(2)10-12)20-16(21)11-18-17(22)19-14-6-4-3-5-7-14/h8-10,14H,3-7,11H2,1-2H3,(H,20,21)(H2,18,19,22)
InChIKeyQQWYVWGRBDQPOT-UHFFFAOYSA-N
MW303.41 g/mol
LogP2.87
Rot. Bonds4

About 2-(cyclohexylcarbamoylamino)-N-(2,4-dimethylphenyl)acetamide

2-(cyclohexylcarbamoylamino)-N-(2,4-dimethylphenyl)acetamide (PubChem CID 112996389) has the molecular formula C17H25N3O2 and a molecular weight of 303.41 g/mol. Its IUPAC name is 2-(cyclohexylcarbamoylamino)-N-(2,4-dimethylphenyl)acetamide.

Molecular Properties

Compound Name2-(cyclohexylcarbamoylamino)-N-(2,4-dimethylphenyl)acetamide
PubChem CID112996389
Molecular FormulaC17H25N3O2
Molecular Weight303.41 g/mol
Exact Mass303.19
IUPAC Name2-(cyclohexylcarbamoylamino)-N-(2,4-dimethylphenyl)acetamide
SMILESCc1ccc(NC(=O)CNC(=O)NC2CCCCC2)c(C)c1
InChIInChI=1S/C17H25N3O2/c1-12-8-9-15(13(2)10-12)20-16(21)11-18-17(22)19-14-6-4-3-5-7-14/h8-10,14H,3-7,11H2,1-2H3,(H,20,21)(H2,18,19,22)
InChIKeyQQWYVWGRBDQPOT-UHFFFAOYSA-N
XLogP2.87
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 52.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-[[2-(cyclohexylcarbamoylamino)acetyl]amino]-3-methylphenoxy]acetic acid
CID 119231714
2-(cyclohexylcarbamoylamino)-N-(2,3-dimethylphenyl)acetamide
CID 51179268
2-(cyclohexylcarbamoylamino)-N-(2,4-dichlorophenyl)acetamide
CID 113001281
N-cyclopropyl-N'-(2,4-dimethylphenyl)propanediamide
CID 108941058
[2-(2,4-dimethylanilino)-2-oxoethyl] 4-(cyclohexylamino)-4-oxobutanoate
CID 9067614
1-cyclopentyl-3-[(2,4-dimethylphenyl)methyl]urea
CID 47322167
2-cyclopentylsulfanyl-N-(2,4-dimethylphenyl)acetamide
CID 6456804
2-(cyclohexylcarbamoylamino)-N-(2-ethoxyphenyl)acetamide
CID 112998805
N-cyclohexyl-4-[(2,4-dimethylphenyl)carbamoylamino]benzamide
CID 17180897
N-cyclohexyl-2-(2,4-dimethylphenyl)acetamide
CID 56922648
1-cycloheptyl-3-[2-(2,4-dimethylphenoxy)ethyl]urea
CID 112973665
N-(4-chloro-2,5-dimethoxyphenyl)-2-(cyclohexylcarbamoylamino)acetamide
CID 113001569

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylcarbamoylamino)-N-(2,4-dimethylphenyl)acetamide?
The IUPAC name of 2-(cyclohexylcarbamoylamino)-N-(2,4-dimethylphenyl)acetamide (CID 112996389) is 2-(cyclohexylcarbamoylamino)-N-(2,4-dimethylphenyl)acetamide.
What is the SMILES notation for 2-(cyclohexylcarbamoylamino)-N-(2,4-dimethylphenyl)acetamide?
The canonical SMILES for 2-(cyclohexylcarbamoylamino)-N-(2,4-dimethylphenyl)acetamide is Cc1ccc(NC(=O)CNC(=O)NC2CCCCC2)c(C)c1.
What is the InChIKey of 2-(cyclohexylcarbamoylamino)-N-(2,4-dimethylphenyl)acetamide?
The InChIKey is QQWYVWGRBDQPOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O2/c1-12-8-9-15(13(2)10-12)20-16(21)11-18-17(22)19-14-6-4-3-5-7-14/h8-10,14H,3-7,11H2,1-2H3,(H,20,21)(H2,18,19,22).
What are the key properties of 2-(cyclohexylcarbamoylamino)-N-(2,4-dimethylphenyl)acetamide?
2-(cyclohexylcarbamoylamino)-N-(2,4-dimethylphenyl)acetamide has a molecular weight of 303.41 g/mol, XLogP of 2.87, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylcarbamoylamino)-N-(2,4-dimethylphenyl)acetamide is sourced from PubChem (CID 112996389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).