2-amino-N-(4-hydroxy-2-methylbutyl)-3-methylbutanamide

C10H22N2O2 — CID 66090902

IUPAC2-amino-N-(4-hydroxy-2-methylbutyl)-3-methylbutanamide
SMILESCC(CCO)CNC(=O)C(N)C(C)C
InChIInChI=1S/C10H22N2O2/c1-7(2)9(11)10(14)12-6-8(3)4-5-13/h7-9,13H,4-6,11H2,1-3H3,(H,12,14)
InChIKeyZMEFVQQPQSNDTI-UHFFFAOYSA-N
MW202.30 g/mol
LogP0.10
Rot. Bonds6

About 2-amino-N-(4-hydroxy-2-methylbutyl)-3-methylbutanamide

2-amino-N-(4-hydroxy-2-methylbutyl)-3-methylbutanamide (PubChem CID 66090902) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 2-amino-N-(4-hydroxy-2-methylbutyl)-3-methylbutanamide.

Molecular Properties

Compound Name2-amino-N-(4-hydroxy-2-methylbutyl)-3-methylbutanamide
PubChem CID66090902
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC Name2-amino-N-(4-hydroxy-2-methylbutyl)-3-methylbutanamide
SMILESCC(CCO)CNC(=O)C(N)C(C)C
InChIInChI=1S/C10H22N2O2/c1-7(2)9(11)10(14)12-6-8(3)4-5-13/h7-9,13H,4-6,11H2,1-3H3,(H,12,14)
InChIKeyZMEFVQQPQSNDTI-UHFFFAOYSA-N
XLogP0.10
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 50.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(3-hydroxy-2-methylpropyl)-3-methylbutanamide
CID 65036026
5-[[(2R)-2-amino-3-methylbutanoyl]amino]-4-methylpentanoic acid
CID 82688347
(2S)-2-amino-N-(4-hydroxy-2-methylbutyl)pentanamide
CID 107569995
2-amino-3-methyl-N-(2-methylpropyl)butanamide
CID 19602466
(2R)-2-amino-3-methyl-N-(2-methyl-3-methylsulfanylpropyl)butanamide
CID 79013022
2-bromo-N-(4-hydroxy-2-methylbutyl)propanamide
CID 107905413
2-amino-N-(4-hydroxy-2-methylbutyl)-3-methoxypropanamide
CID 81102467
(2S)-2-amino-N-(4-hydroxy-2-methylbutyl)hexanamide
CID 107145862
(2S)-2-amino-N-(2,3-dihydroxypropyl)-3-methylbutanamide
CID 65440271
2-(carbamoylamino)-N-(4-hydroxy-2-methylbutyl)propanamide
CID 66106637
2-amino-N-(4-hydroxy-2-methylbutyl)-4-methylsulfonylbutanamide
CID 66091622
2-amino-N-(4-hydroxy-2-methylbutyl)acetamide
CID 66089038

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-hydroxy-2-methylbutyl)-3-methylbutanamide?
The IUPAC name of 2-amino-N-(4-hydroxy-2-methylbutyl)-3-methylbutanamide (CID 66090902) is 2-amino-N-(4-hydroxy-2-methylbutyl)-3-methylbutanamide.
What is the SMILES notation for 2-amino-N-(4-hydroxy-2-methylbutyl)-3-methylbutanamide?
The canonical SMILES for 2-amino-N-(4-hydroxy-2-methylbutyl)-3-methylbutanamide is CC(CCO)CNC(=O)C(N)C(C)C.
What is the InChIKey of 2-amino-N-(4-hydroxy-2-methylbutyl)-3-methylbutanamide?
The InChIKey is ZMEFVQQPQSNDTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-7(2)9(11)10(14)12-6-8(3)4-5-13/h7-9,13H,4-6,11H2,1-3H3,(H,12,14).
What are the key properties of 2-amino-N-(4-hydroxy-2-methylbutyl)-3-methylbutanamide?
2-amino-N-(4-hydroxy-2-methylbutyl)-3-methylbutanamide has a molecular weight of 202.30 g/mol, XLogP of 0.10, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-hydroxy-2-methylbutyl)-3-methylbutanamide is sourced from PubChem (CID 66090902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).