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

C10H21NO2 — CID 74554703

IUPACN-(1-hydroxy-3-methylbutan-2-yl)-3-methylbutanamide
SMILESCC(C)CC(=O)NC(CO)C(C)C
InChIInChI=1S/C10H21NO2/c1-7(2)5-10(13)11-9(6-12)8(3)4/h7-9,12H,5-6H2,1-4H3,(H,11,13)
InChIKeyNLZIGPBLTOEIQY-UHFFFAOYSA-N
MW187.28 g/mol
LogP1.17
Rot. Bonds5

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

N-(1-hydroxy-3-methylbutan-2-yl)-3-methylbutanamide (PubChem CID 74554703) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is N-(1-hydroxy-3-methylbutan-2-yl)-3-methylbutanamide.

Molecular Properties

Compound NameN-(1-hydroxy-3-methylbutan-2-yl)-3-methylbutanamide
PubChem CID74554703
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC NameN-(1-hydroxy-3-methylbutan-2-yl)-3-methylbutanamide
SMILESCC(C)CC(=O)NC(CO)C(C)C
InChIInChI=1S/C10H21NO2/c1-7(2)5-10(13)11-9(6-12)8(3)4/h7-9,12H,5-6H2,1-4H3,(H,11,13)
InChIKeyNLZIGPBLTOEIQY-UHFFFAOYSA-N
XLogP1.17
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-(1-hydroxy-3-methylbutan-2-yl)butanamide
CID 79249380
2-chloro-N-(1-hydroxy-3-methylbutan-2-yl)acetamide
CID 79249423
N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-4-methyl-2-methylidenepentanamide
CID 136588740
4-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-methoxybutanamide
CID 103156180
N-[(2R)-1-hydroxy-3-methylbutan-2-yl]-2-methylpropanamide
CID 39086818
N-(1-hydroxy-3-methylbutan-2-yl)-3-methoxypropanamide
CID 79252546
3-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-methylbutanamide
CID 79250532
4,4,4-trifluoro-N-(1-hydroxy-3-methylbutan-2-yl)butanamide
CID 79252390
N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3-(propan-2-ylamino)propanamide
CID 79249728
2-cyclopropyl-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]acetamide
CID 79252136
N-(1-hydroxy-3-methylbutan-2-yl)hexadecanamide
CID 21299171
N-(1-hydroxy-3-methylbutan-2-yl)-2-(propylamino)acetamide
CID 79249827

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-3-methylbutan-2-yl)-3-methylbutanamide?
The IUPAC name of N-(1-hydroxy-3-methylbutan-2-yl)-3-methylbutanamide (CID 74554703) is N-(1-hydroxy-3-methylbutan-2-yl)-3-methylbutanamide.
What is the SMILES notation for N-(1-hydroxy-3-methylbutan-2-yl)-3-methylbutanamide?
The canonical SMILES for N-(1-hydroxy-3-methylbutan-2-yl)-3-methylbutanamide is CC(C)CC(=O)NC(CO)C(C)C.
What is the InChIKey of N-(1-hydroxy-3-methylbutan-2-yl)-3-methylbutanamide?
The InChIKey is NLZIGPBLTOEIQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-7(2)5-10(13)11-9(6-12)8(3)4/h7-9,12H,5-6H2,1-4H3,(H,11,13).
What are the key properties of N-(1-hydroxy-3-methylbutan-2-yl)-3-methylbutanamide?
N-(1-hydroxy-3-methylbutan-2-yl)-3-methylbutanamide has a molecular weight of 187.28 g/mol, XLogP of 1.17, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-3-methylbutan-2-yl)-3-methylbutanamide is sourced from PubChem (CID 74554703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).