N-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-hydroxy-4-methylpentanamide

C15H29NO3 — CID 119034461

IUPACN-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-hydroxy-4-methylpentanamide
SMILESCC(C)C(O)CC(=O)NC(C)(CO)C1CCCCC1
InChIInChI=1S/C15H29NO3/c1-11(2)13(18)9-14(19)16-15(3,10-17)12-7-5-4-6-8-12/h11-13,17-18H,4-10H2,1-3H3,(H,16,19)
InChIKeyAWMNZWMHDZRGLO-UHFFFAOYSA-N
MW271.40 g/mol
LogP1.84
Rot. Bonds6

About N-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-hydroxy-4-methylpentanamide

N-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-hydroxy-4-methylpentanamide (PubChem CID 119034461) has the molecular formula C15H29NO3 and a molecular weight of 271.40 g/mol. Its IUPAC name is N-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-hydroxy-4-methylpentanamide.

Molecular Properties

Compound NameN-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-hydroxy-4-methylpentanamide
PubChem CID119034461
Molecular FormulaC15H29NO3
Molecular Weight271.40 g/mol
Exact Mass271.21
IUPAC NameN-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-hydroxy-4-methylpentanamide
SMILESCC(C)C(O)CC(=O)NC(C)(CO)C1CCCCC1
InChIInChI=1S/C15H29NO3/c1-11(2)13(18)9-14(19)16-15(3,10-17)12-7-5-4-6-8-12/h11-13,17-18H,4-10H2,1-3H3,(H,16,19)
InChIKeyAWMNZWMHDZRGLO-UHFFFAOYSA-N
XLogP1.84
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 51.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-hydroxy-4-methylpentanamide?
The IUPAC name of N-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-hydroxy-4-methylpentanamide (CID 119034461) is N-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-hydroxy-4-methylpentanamide.
What is the SMILES notation for N-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-hydroxy-4-methylpentanamide?
The canonical SMILES for N-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-hydroxy-4-methylpentanamide is CC(C)C(O)CC(=O)NC(C)(CO)C1CCCCC1.
What is the InChIKey of N-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-hydroxy-4-methylpentanamide?
The InChIKey is AWMNZWMHDZRGLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO3/c1-11(2)13(18)9-14(19)16-15(3,10-17)12-7-5-4-6-8-12/h11-13,17-18H,4-10H2,1-3H3,(H,16,19).
What are the key properties of N-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-hydroxy-4-methylpentanamide?
N-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-hydroxy-4-methylpentanamide has a molecular weight of 271.40 g/mol, XLogP of 1.84, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexyl-1-hydroxypropan-2-yl)-3-hydroxy-4-methylpentanamide is sourced from PubChem (CID 119034461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).