2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]pentanamide

C10H22N2O2 — CID 79249157

IUPAC2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]pentanamide
SMILESCCCC(N)C(=O)N[C@H](CO)C(C)C
InChIInChI=1S/C10H22N2O2/c1-4-5-8(11)10(14)12-9(6-13)7(2)3/h7-9,13H,4-6,11H2,1-3H3,(H,12,14)/t8?,9-/m1/s1
InChIKeyWSFNHHHQYLSPDD-YGPZHTELSA-N
MW202.30 g/mol
LogP0.25
Rot. Bonds6

About 2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]pentanamide

2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]pentanamide (PubChem CID 79249157) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]pentanamide.

Molecular Properties

Compound Name2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]pentanamide
PubChem CID79249157
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC Name2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]pentanamide
SMILESCCCC(N)C(=O)N[C@H](CO)C(C)C
InChIInChI=1S/C10H22N2O2/c1-4-5-8(11)10(14)12-9(6-13)7(2)3/h7-9,13H,4-6,11H2,1-3H3,(H,12,14)/t8?,9-/m1/s1
InChIKeyWSFNHHHQYLSPDD-YGPZHTELSA-N
XLogP0.25
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 ≤ 50.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[(2S)-2-aminopentanoyl]amino]-4-methylpentanoic acid
CID 107570372
(2R)-2-amino-N-[1-(dimethylamino)-3-methylbutan-2-yl]pentanamide
CID 103813848
2-amino-N-(3-methylbutan-2-yl)pentanamide
CID 43650228
2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-5-methoxypentanamide
CID 81100884
2-amino-N-[(2S)-1-hydroxybutan-2-yl]pentanamide
CID 107222375
(2S)-2-amino-N-[(2S)-1-hydroxybutan-2-yl]pentanamide
CID 107571000
N-[(2R)-1-hydroxy-3-methylbutan-2-yl]-2-methylpropanamide
CID 39086818
(2S)-2-amino-N-(1-hydroxy-3-methylbutan-2-yl)-3,3-dimethylbutanamide
CID 79250278
methyl (2S)-2-[[(2R)-2-aminopentanoyl]amino]-3-methylbutanoate
CID 107568571
(2R)-2-amino-N-[1-(methylamino)-1-oxopropan-2-yl]pentanamide
CID 103795688
(2S)-2-amino-N-hexan-3-ylpentanamide
CID 107569552
2-amino-N-(1-ethylsulfonylpropan-2-yl)pentanamide
CID 119325448

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]pentanamide?
The IUPAC name of 2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]pentanamide (CID 79249157) is 2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]pentanamide.
What is the SMILES notation for 2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]pentanamide?
The canonical SMILES for 2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]pentanamide is CCCC(N)C(=O)N[C@H](CO)C(C)C.
What is the InChIKey of 2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]pentanamide?
The InChIKey is WSFNHHHQYLSPDD-YGPZHTELSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-4-5-8(11)10(14)12-9(6-13)7(2)3/h7-9,13H,4-6,11H2,1-3H3,(H,12,14)/t8?,9-/m1/s1.
What are the key properties of 2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]pentanamide?
2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]pentanamide has a molecular weight of 202.30 g/mol, XLogP of 0.25, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]pentanamide is sourced from PubChem (CID 79249157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).