3-cyclohexyl-N-(5-hydroxy-4-methylpentyl)propanamide

C15H29NO2 — CID 113340801

IUPAC3-cyclohexyl-N-(5-hydroxy-4-methylpentyl)propanamide
SMILESCC(CO)CCCNC(=O)CCC1CCCCC1
InChIInChI=1S/C15H29NO2/c1-13(12-17)6-5-11-16-15(18)10-9-14-7-3-2-4-8-14/h13-14,17H,2-12H2,1H3,(H,16,18)
InChIKeyURJUEJBFFZRHPC-UHFFFAOYSA-N
MW255.40 g/mol
LogP2.87
Rot. Bonds8

About 3-cyclohexyl-N-(5-hydroxy-4-methylpentyl)propanamide

3-cyclohexyl-N-(5-hydroxy-4-methylpentyl)propanamide (PubChem CID 113340801) has the molecular formula C15H29NO2 and a molecular weight of 255.40 g/mol. Its IUPAC name is 3-cyclohexyl-N-(5-hydroxy-4-methylpentyl)propanamide.

Molecular Properties

Compound Name3-cyclohexyl-N-(5-hydroxy-4-methylpentyl)propanamide
PubChem CID113340801
Molecular FormulaC15H29NO2
Molecular Weight255.40 g/mol
Exact Mass255.22
IUPAC Name3-cyclohexyl-N-(5-hydroxy-4-methylpentyl)propanamide
SMILESCC(CO)CCCNC(=O)CCC1CCCCC1
InChIInChI=1S/C15H29NO2/c1-13(12-17)6-5-11-16-15(18)10-9-14-7-3-2-4-8-14/h13-14,17H,2-12H2,1H3,(H,16,18)
InChIKeyURJUEJBFFZRHPC-UHFFFAOYSA-N
XLogP2.87
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.40
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(4-chloropentyl)-3-cyclopentylpropanamide
CID 106129653
3-cyclopentyl-N-[7-(3-cyclopentylpropanoylamino)heptyl]propanamide
CID 5183874
3-cyclohexyl-N-undecylpropanamide
CID 5146202
4-amino-N-(3-cyclohexylpropyl)pentanamide;hydrochloride
CID 120560365
3-cyclohexyl-N-(1-hydroxypropan-2-yl)propanamide
CID 43418810
N-(5-hydroxy-4-methylpentyl)pent-4-ynamide
CID 106155721
3-cyclopentyl-N-[2-(3-hydroxybutylamino)-2-oxoethyl]propanamide
CID 111433458
N-(5-chloro-4-methylpentyl)-2-cycloheptylacetamide
CID 106157136
N-(5-hydroxy-4-methylpentyl)-3-pyrrolidin-1-ylpropanamide
CID 113340869
3-cyclohexyl-N-[2-(2-hydroxypropylamino)ethyl]propanamide
CID 104593625
N-(3-bromo-2-methylpropyl)-3-cyclohexylpropanamide
CID 114313527
4-(3-cyclohexylpropanoylamino)-2-hydroxybutanoic acid
CID 114006236

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-N-(5-hydroxy-4-methylpentyl)propanamide?
The IUPAC name of 3-cyclohexyl-N-(5-hydroxy-4-methylpentyl)propanamide (CID 113340801) is 3-cyclohexyl-N-(5-hydroxy-4-methylpentyl)propanamide.
What is the SMILES notation for 3-cyclohexyl-N-(5-hydroxy-4-methylpentyl)propanamide?
The canonical SMILES for 3-cyclohexyl-N-(5-hydroxy-4-methylpentyl)propanamide is CC(CO)CCCNC(=O)CCC1CCCCC1.
What is the InChIKey of 3-cyclohexyl-N-(5-hydroxy-4-methylpentyl)propanamide?
The InChIKey is URJUEJBFFZRHPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO2/c1-13(12-17)6-5-11-16-15(18)10-9-14-7-3-2-4-8-14/h13-14,17H,2-12H2,1H3,(H,16,18).
What are the key properties of 3-cyclohexyl-N-(5-hydroxy-4-methylpentyl)propanamide?
3-cyclohexyl-N-(5-hydroxy-4-methylpentyl)propanamide has a molecular weight of 255.40 g/mol, XLogP of 2.87, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-N-(5-hydroxy-4-methylpentyl)propanamide is sourced from PubChem (CID 113340801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).