N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpentanamide

C11H23NO2 — CID 114875408

IUPACN-(1-hydroxy-2-methylbutan-2-yl)-3-methylpentanamide
SMILESCCC(C)CC(=O)NC(C)(CC)CO
InChIInChI=1S/C11H23NO2/c1-5-9(3)7-10(14)12-11(4,6-2)8-13/h9,13H,5-8H2,1-4H3,(H,12,14)
InChIKeyHXDHXXNWJGKHOV-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.70
Rot. Bonds6

About N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpentanamide

N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpentanamide (PubChem CID 114875408) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpentanamide.

Molecular Properties

Compound NameN-(1-hydroxy-2-methylbutan-2-yl)-3-methylpentanamide
PubChem CID114875408
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC NameN-(1-hydroxy-2-methylbutan-2-yl)-3-methylpentanamide
SMILESCCC(C)CC(=O)NC(C)(CC)CO
InChIInChI=1S/C11H23NO2/c1-5-9(3)7-10(14)12-11(4,6-2)8-13/h9,13H,5-8H2,1-4H3,(H,12,14)
InChIKeyHXDHXXNWJGKHOV-UHFFFAOYSA-N
XLogP1.70
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 ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-hydroxy-2-methylbutan-2-yl)-3-methylbutanamide
CID 64556014
5-[(1-hydroxy-2-methylbutan-2-yl)amino]-3-methyl-5-oxopentanoic acid
CID 64549300
N-(1-chloro-3-methylpentan-3-yl)-3-methylpentanamide
CID 106168655
3-(ethylamino)-N-(1-hydroxy-2-methylbutan-2-yl)butanamide
CID 64550140
3-methyl-5-(3-methylpentan-3-ylamino)-5-oxopentanoic acid
CID 106328220
N-(4-hydroxy-2-methylbutan-2-yl)-3-methylpentanamide
CID 114875470
N-(1-amino-2,4-dimethylpentan-2-yl)-3-methylpentanamide
CID 114875694
2-ethyl-N-(1-hydroxy-2-methylbutan-2-yl)butanamide
CID 64557769
N-(1-hydroxy-2-phenylpropan-2-yl)-3-methylpentanamide
CID 105058924
N-(1-amino-2-methyl-1-sulfanylidenepropan-2-yl)-3-methylpentanamide
CID 114874782
N-(2,3-dihydroxy-2-methylpropyl)-3-methylpentanamide
CID 114875437
propan-2-yl N-(1-hydroxy-2-methylbutan-2-yl)carbamate
CID 64557205

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpentanamide?
The IUPAC name of N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpentanamide (CID 114875408) is N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpentanamide.
What is the SMILES notation for N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpentanamide?
The canonical SMILES for N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpentanamide is CCC(C)CC(=O)NC(C)(CC)CO.
What is the InChIKey of N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpentanamide?
The InChIKey is HXDHXXNWJGKHOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-5-9(3)7-10(14)12-11(4,6-2)8-13/h9,13H,5-8H2,1-4H3,(H,12,14).
What are the key properties of N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpentanamide?
N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpentanamide has a molecular weight of 201.31 g/mol, XLogP of 1.70, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpentanamide is sourced from PubChem (CID 114875408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).