3-cyclohexyl-N-(2-methylpropyl)propanamide

C13H25NO — CID 803724

IUPAC3-cyclohexyl-N-(2-methylpropyl)propanamide
SMILESCC(C)CNC(=O)CCC1CCCCC1
InChIInChI=1S/C13H25NO/c1-11(2)10-14-13(15)9-8-12-6-4-3-5-7-12/h11-12H,3-10H2,1-2H3,(H,14,15)
InChIKeyGRLGYBLDGZSHMV-UHFFFAOYSA-N
MW211.35 g/mol
LogP3.12
Rot. Bonds5

About 3-cyclohexyl-N-(2-methylpropyl)propanamide

3-cyclohexyl-N-(2-methylpropyl)propanamide (PubChem CID 803724) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is 3-cyclohexyl-N-(2-methylpropyl)propanamide.

Molecular Properties

Compound Name3-cyclohexyl-N-(2-methylpropyl)propanamide
PubChem CID803724
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name3-cyclohexyl-N-(2-methylpropyl)propanamide
SMILESCC(C)CNC(=O)CCC1CCCCC1
InChIInChI=1S/C13H25NO/c1-11(2)10-14-13(15)9-8-12-6-4-3-5-7-12/h11-12H,3-10H2,1-2H3,(H,14,15)
InChIKeyGRLGYBLDGZSHMV-UHFFFAOYSA-N
XLogP3.12
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-N-(2-methylpropyl)propanamide?
The IUPAC name of 3-cyclohexyl-N-(2-methylpropyl)propanamide (CID 803724) is 3-cyclohexyl-N-(2-methylpropyl)propanamide.
What is the SMILES notation for 3-cyclohexyl-N-(2-methylpropyl)propanamide?
The canonical SMILES for 3-cyclohexyl-N-(2-methylpropyl)propanamide is CC(C)CNC(=O)CCC1CCCCC1.
What is the InChIKey of 3-cyclohexyl-N-(2-methylpropyl)propanamide?
The InChIKey is GRLGYBLDGZSHMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-11(2)10-14-13(15)9-8-12-6-4-3-5-7-12/h11-12H,3-10H2,1-2H3,(H,14,15).
What are the key properties of 3-cyclohexyl-N-(2-methylpropyl)propanamide?
3-cyclohexyl-N-(2-methylpropyl)propanamide has a molecular weight of 211.35 g/mol, XLogP of 3.12, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-N-(2-methylpropyl)propanamide is sourced from PubChem (CID 803724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).