2-amino-N-(4-hydroxy-2,2-dimethylbutyl)-3-methylbutanamide

C11H24N2O2 — CID 106147902

IUPAC2-amino-N-(4-hydroxy-2,2-dimethylbutyl)-3-methylbutanamide
SMILESCC(C)C(N)C(=O)NCC(C)(C)CCO
InChIInChI=1S/C11H24N2O2/c1-8(2)9(12)10(15)13-7-11(3,4)5-6-14/h8-9,14H,5-7,12H2,1-4H3,(H,13,15)
InChIKeyXMLZRACWAUFJNW-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.49
Rot. Bonds6

About 2-amino-N-(4-hydroxy-2,2-dimethylbutyl)-3-methylbutanamide

2-amino-N-(4-hydroxy-2,2-dimethylbutyl)-3-methylbutanamide (PubChem CID 106147902) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 2-amino-N-(4-hydroxy-2,2-dimethylbutyl)-3-methylbutanamide.

Molecular Properties

Compound Name2-amino-N-(4-hydroxy-2,2-dimethylbutyl)-3-methylbutanamide
PubChem CID106147902
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name2-amino-N-(4-hydroxy-2,2-dimethylbutyl)-3-methylbutanamide
SMILESCC(C)C(N)C(=O)NCC(C)(C)CCO
InChIInChI=1S/C11H24N2O2/c1-8(2)9(12)10(15)13-7-11(3,4)5-6-14/h8-9,14H,5-7,12H2,1-4H3,(H,13,15)
InChIKeyXMLZRACWAUFJNW-UHFFFAOYSA-N
XLogP0.49
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-[2-[(5-hydroxy-2,2-dimethylpentyl)amino]-2-oxoethyl]-3-methylbutanamide
CID 106148305
(2S)-2-amino-N-(5-hydroxy-2,2-dimethylpentyl)-3,3-dimethylbutanamide
CID 114150116
(2R)-2-amino-N-(2-hydroxy-4-methoxy-2-methylbutyl)-3-methylbutanamide
CID 106254016
(2S)-2-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-3-methylbutanamide;hydrochloride
CID 119296292
(2S)-2-amino-N-[2-(dimethylamino)-2-methylpropyl]-3-methylbutanamide
CID 61250015
(2S)-2-amino-3-methyl-N-(2-methyl-2-methylsulfonylpropyl)butanamide
CID 79551034
(2R)-2-amino-N-(4-hydroxy-2,2-dimethylbutyl)-4-methylsulfanylbutanamide
CID 106148043
N-(4-amino-2,2-dimethylbutyl)-3-methyl-2-propan-2-ylbutanamide
CID 114282359
2-amino-N-(4-hydroxy-2-methylbutyl)-3-methylbutanamide
CID 66090902
2-amino-3-methyl-N-(2-methylpropyl)butanamide
CID 19602466
(2S)-2-amino-N-(3-hydroxy-2,2-dimethylpropyl)propanamide
CID 115360252
2-amino-N-(3-hydroxy-2-methylpropyl)-3-methylbutanamide
CID 65036026

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-hydroxy-2,2-dimethylbutyl)-3-methylbutanamide?
The IUPAC name of 2-amino-N-(4-hydroxy-2,2-dimethylbutyl)-3-methylbutanamide (CID 106147902) is 2-amino-N-(4-hydroxy-2,2-dimethylbutyl)-3-methylbutanamide.
What is the SMILES notation for 2-amino-N-(4-hydroxy-2,2-dimethylbutyl)-3-methylbutanamide?
The canonical SMILES for 2-amino-N-(4-hydroxy-2,2-dimethylbutyl)-3-methylbutanamide is CC(C)C(N)C(=O)NCC(C)(C)CCO.
What is the InChIKey of 2-amino-N-(4-hydroxy-2,2-dimethylbutyl)-3-methylbutanamide?
The InChIKey is XMLZRACWAUFJNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-8(2)9(12)10(15)13-7-11(3,4)5-6-14/h8-9,14H,5-7,12H2,1-4H3,(H,13,15).
What are the key properties of 2-amino-N-(4-hydroxy-2,2-dimethylbutyl)-3-methylbutanamide?
2-amino-N-(4-hydroxy-2,2-dimethylbutyl)-3-methylbutanamide has a molecular weight of 216.32 g/mol, XLogP of 0.49, 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-2,2-dimethylbutyl)-3-methylbutanamide is sourced from PubChem (CID 106147902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).