5-methyl-3-(2-methylpropyl)hexanamide

C11H23NO — CID 87709322

IUPAC5-methyl-3-(2-methylpropyl)hexanamide
SMILESCC(C)CC(CC(N)=O)CC(C)C
InChIInChI=1S/C11H23NO/c1-8(2)5-10(6-9(3)4)7-11(12)13/h8-10H,5-7H2,1-4H3,(H2,12,13)
InChIKeyIEYXADPVGIGECR-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.57
Rot. Bonds6

About 5-methyl-3-(2-methylpropyl)hexanamide

5-methyl-3-(2-methylpropyl)hexanamide (PubChem CID 87709322) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 5-methyl-3-(2-methylpropyl)hexanamide.

Molecular Properties

Compound Name5-methyl-3-(2-methylpropyl)hexanamide
PubChem CID87709322
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name5-methyl-3-(2-methylpropyl)hexanamide
SMILESCC(C)CC(CC(N)=O)CC(C)C
InChIInChI=1S/C11H23NO/c1-8(2)5-10(6-9(3)4)7-11(12)13/h8-10H,5-7H2,1-4H3,(H2,12,13)
InChIKeyIEYXADPVGIGECR-UHFFFAOYSA-N
XLogP2.57
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

azanium (3R)-3-(2-amino-2-oxoethyl)-5-methylhexanoate
CID 23653061
3-methylbutanamide
CID 87933309
N-[2-(2-amino-2-oxoethyl)-4-methylpentyl]-methylboronamidic acid
CID 22970370
(2R)-2-(2-methylpropyl)butanediamide
CID 22942178
5-methyl-3-(2-methylpropyl)hexanoyl chloride
CID 119094600
(3R)-3-(2-amino-2-oxoethyl)-6-methyl-5-propan-2-ylheptanoic acid
CID 163670628
3-(ethylamino)-5-methylhexanamide
CID 64989014
3-(aminomethyl)-5-methylhexanoic acid
CID 4715169
(3S)-3-aminobutanamide;hydrochloride
CID 57478871
3-hydroxy-4,5-dimethylhexanamide
CID 89154230
(3S)-3-[2-hydroperoxy-2-(2-nitrophenyl)ethyl]-5-methylhexanamide
CID 88554292
(2S)-2-amino-N-(4-amino-4-oxobutan-2-yl)-4-methylpentanamide
CID 103812202

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-(2-methylpropyl)hexanamide?
The IUPAC name of 5-methyl-3-(2-methylpropyl)hexanamide (CID 87709322) is 5-methyl-3-(2-methylpropyl)hexanamide.
What is the SMILES notation for 5-methyl-3-(2-methylpropyl)hexanamide?
The canonical SMILES for 5-methyl-3-(2-methylpropyl)hexanamide is CC(C)CC(CC(N)=O)CC(C)C.
What is the InChIKey of 5-methyl-3-(2-methylpropyl)hexanamide?
The InChIKey is IEYXADPVGIGECR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-8(2)5-10(6-9(3)4)7-11(12)13/h8-10H,5-7H2,1-4H3,(H2,12,13).
What are the key properties of 5-methyl-3-(2-methylpropyl)hexanamide?
5-methyl-3-(2-methylpropyl)hexanamide has a molecular weight of 185.31 g/mol, XLogP of 2.57, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-(2-methylpropyl)hexanamide is sourced from PubChem (CID 87709322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).