N-(4-hydroxy-3-methylbutan-2-yl)-3-methylpentanamide

C11H23NO2 — CID 114875462

IUPACN-(4-hydroxy-3-methylbutan-2-yl)-3-methylpentanamide
SMILESCCC(C)CC(=O)NC(C)C(C)CO
InChIInChI=1S/C11H23NO2/c1-5-8(2)6-11(14)12-10(4)9(3)7-13/h8-10,13H,5-7H2,1-4H3,(H,12,14)
InChIKeyAMKLLGXEQJKWIE-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.56
Rot. Bonds6

About N-(4-hydroxy-3-methylbutan-2-yl)-3-methylpentanamide

N-(4-hydroxy-3-methylbutan-2-yl)-3-methylpentanamide (PubChem CID 114875462) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is N-(4-hydroxy-3-methylbutan-2-yl)-3-methylpentanamide.

Molecular Properties

Compound NameN-(4-hydroxy-3-methylbutan-2-yl)-3-methylpentanamide
PubChem CID114875462
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC NameN-(4-hydroxy-3-methylbutan-2-yl)-3-methylpentanamide
SMILESCCC(C)CC(=O)NC(C)C(C)CO
InChIInChI=1S/C11H23NO2/c1-5-8(2)6-11(14)12-10(4)9(3)7-13/h8-10,13H,5-7H2,1-4H3,(H,12,14)
InChIKeyAMKLLGXEQJKWIE-UHFFFAOYSA-N
XLogP1.56
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-chloro-3-methylbutan-2-yl)-3-methylpentanamide
CID 114877077
N-(1-bromopropan-2-yl)-3-methylpentanamide
CID 114876990
N-(4-hydroxy-3-methylbutan-2-yl)decanamide
CID 115770870
N-[(2R)-3-methylpentan-2-yl]propanamide
CID 145216410
(2S)-3-methyl-2-(3-methylpentanoylamino)butanoic acid
CID 104982198
ethyl 4-[(4-hydroxy-3-methylbutan-2-yl)amino]-4-oxobutanoate
CID 115770889
3-hydroxy-2-(3-methylpentanoylamino)butanoic acid
CID 114873567
N-(1-chloro-4-methylpentan-2-yl)-3-methylpentanamide
CID 114876936
5-(3-methylpentanoylamino)hexanoic acid
CID 114873856
N-hex-5-yn-3-yl-3-methylpentanamide
CID 114876499
2-methylpropyl 2-(3-methylpentanoylamino)propanoate
CID 22492175
N-(4-hydroxy-3-methylbutan-2-yl)-2,2-dimethylpropanamide
CID 115734890

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxy-3-methylbutan-2-yl)-3-methylpentanamide?
The IUPAC name of N-(4-hydroxy-3-methylbutan-2-yl)-3-methylpentanamide (CID 114875462) is N-(4-hydroxy-3-methylbutan-2-yl)-3-methylpentanamide.
What is the SMILES notation for N-(4-hydroxy-3-methylbutan-2-yl)-3-methylpentanamide?
The canonical SMILES for N-(4-hydroxy-3-methylbutan-2-yl)-3-methylpentanamide is CCC(C)CC(=O)NC(C)C(C)CO.
What is the InChIKey of N-(4-hydroxy-3-methylbutan-2-yl)-3-methylpentanamide?
The InChIKey is AMKLLGXEQJKWIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-5-8(2)6-11(14)12-10(4)9(3)7-13/h8-10,13H,5-7H2,1-4H3,(H,12,14).
What are the key properties of N-(4-hydroxy-3-methylbutan-2-yl)-3-methylpentanamide?
N-(4-hydroxy-3-methylbutan-2-yl)-3-methylpentanamide has a molecular weight of 201.31 g/mol, XLogP of 1.56, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxy-3-methylbutan-2-yl)-3-methylpentanamide is sourced from PubChem (CID 114875462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).