3-amino-2-hydroxy-N-[(2S)-3-methylbutan-2-yl]hexanamide

C11H24N2O2 — CID 142118919

IUPAC3-amino-2-hydroxy-N-[(2S)-3-methylbutan-2-yl]hexanamide
SMILESCCCC(N)C(O)C(=O)N[C@@H](C)C(C)C
InChIInChI=1S/C11H24N2O2/c1-5-6-9(12)10(14)11(15)13-8(4)7(2)3/h7-10,14H,5-6,12H2,1-4H3,(H,13,15)/t8-,9?,10?/m0/s1
InChIKeyPRCMLDGUBAPPKG-IDKOKCKLSA-N
MW216.32 g/mol
LogP0.64
Rot. Bonds6

About 3-amino-2-hydroxy-N-[(2S)-3-methylbutan-2-yl]hexanamide

3-amino-2-hydroxy-N-[(2S)-3-methylbutan-2-yl]hexanamide (PubChem CID 142118919) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 3-amino-2-hydroxy-N-[(2S)-3-methylbutan-2-yl]hexanamide.

Molecular Properties

Compound Name3-amino-2-hydroxy-N-[(2S)-3-methylbutan-2-yl]hexanamide
PubChem CID142118919
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name3-amino-2-hydroxy-N-[(2S)-3-methylbutan-2-yl]hexanamide
SMILESCCCC(N)C(O)C(=O)N[C@@H](C)C(C)C
InChIInChI=1S/C11H24N2O2/c1-5-6-9(12)10(14)11(15)13-8(4)7(2)3/h7-10,14H,5-6,12H2,1-4H3,(H,13,15)/t8-,9?,10?/m0/s1
InChIKeyPRCMLDGUBAPPKG-IDKOKCKLSA-N
XLogP0.64
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 ≤ 50.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-amino-2-hydroxy-N-[(2S)-3-methylbutan-2-yl]hexanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-amino-N-(3-methylbutan-2-yl)pentanamide
CID 43650228
(2S,3S)-3-amino-N-ethyl-2-hydroxyhexanamide;dihydrochloride
CID 86762425
(3S)-3-amino-N-cyclopropyl-2-hydroxyhexanamide
CID 23634853
(2S)-2-[[(2R,3S)-3-amino-2-hydroxyoctanoyl]amino]-3-methylbutanoic acid
CID 10588397
methyl (2S,3R)-3-amino-2-hydroxyhexanoate
CID 56605369
(4S)-4-amino-3-hydroxyheptan-2-one
CID 58331979
(2S,3S)-3-amino-2-hydroxyhexanoic acid
CID 11205843
(3S)-3-amino-N-[2-[[(2S)-1-(dimethylamino)-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]-2-hydroxyhexanamide
CID 87495872
methyl (3S)-3-amino-2-hydroxyhexanoate;hydrochloride
CID 90189651
(2S,3S)-3-amino-2-hydroxy-N-(2,2,2-trifluoroethyl)hexanamide
CID 86762421
3-amino-2-hydroxy-N-prop-2-enylhexanamide;hydrochloride
CID 139291083
5-acetyl-3-amino-2-hydroxy-N-propan-2-yloctanamide
CID 142297411

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-hydroxy-N-[(2S)-3-methylbutan-2-yl]hexanamide?
The IUPAC name of 3-amino-2-hydroxy-N-[(2S)-3-methylbutan-2-yl]hexanamide (CID 142118919) is 3-amino-2-hydroxy-N-[(2S)-3-methylbutan-2-yl]hexanamide.
What is the SMILES notation for 3-amino-2-hydroxy-N-[(2S)-3-methylbutan-2-yl]hexanamide?
The canonical SMILES for 3-amino-2-hydroxy-N-[(2S)-3-methylbutan-2-yl]hexanamide is CCCC(N)C(O)C(=O)N[C@@H](C)C(C)C.
What is the InChIKey of 3-amino-2-hydroxy-N-[(2S)-3-methylbutan-2-yl]hexanamide?
The InChIKey is PRCMLDGUBAPPKG-IDKOKCKLSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-5-6-9(12)10(14)11(15)13-8(4)7(2)3/h7-10,14H,5-6,12H2,1-4H3,(H,13,15)/t8-,9?,10?/m0/s1.
What are the key properties of 3-amino-2-hydroxy-N-[(2S)-3-methylbutan-2-yl]hexanamide?
3-amino-2-hydroxy-N-[(2S)-3-methylbutan-2-yl]hexanamide has a molecular weight of 216.32 g/mol, XLogP of 0.64, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-hydroxy-N-[(2S)-3-methylbutan-2-yl]hexanamide is sourced from PubChem (CID 142118919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).