(2R)-2-amino-N-(4-hydroxybutan-2-yl)butanamide

C8H18N2O2 — CID 83177321

IUPAC(2R)-2-amino-N-(4-hydroxybutan-2-yl)butanamide
SMILESCC[C@@H](N)C(=O)NC(C)CCO
InChIInChI=1S/C8H18N2O2/c1-3-7(9)8(12)10-6(2)4-5-11/h6-7,11H,3-5,9H2,1-2H3,(H,10,12)/t6?,7-/m1/s1
InChIKeyWVJCZXSJMFNEQK-COBSHVIPSA-N
MW174.24 g/mol
LogP-0.39
Rot. Bonds5

About (2R)-2-amino-N-(4-hydroxybutan-2-yl)butanamide

(2R)-2-amino-N-(4-hydroxybutan-2-yl)butanamide (PubChem CID 83177321) has the molecular formula C8H18N2O2 and a molecular weight of 174.24 g/mol. Its IUPAC name is (2R)-2-amino-N-(4-hydroxybutan-2-yl)butanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(4-hydroxybutan-2-yl)butanamide
PubChem CID83177321
Molecular FormulaC8H18N2O2
Molecular Weight174.24 g/mol
Exact Mass174.14
IUPAC Name(2R)-2-amino-N-(4-hydroxybutan-2-yl)butanamide
SMILESCC[C@@H](N)C(=O)NC(C)CCO
InChIInChI=1S/C8H18N2O2/c1-3-7(9)8(12)10-6(2)4-5-11/h6-7,11H,3-5,9H2,1-2H3,(H,10,12)/t6?,7-/m1/s1
InChIKeyWVJCZXSJMFNEQK-COBSHVIPSA-N
XLogP-0.39
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.24
LogP ≤ 5-0.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-hexan-2-ylbutanamide
CID 79023466
2-amino-N-(4-hydroxybutan-2-yl)-4-methylsulfonylbutanamide
CID 83178040
(2R)-2-amino-N-[(2R)-1-aminopropan-2-yl]butanamide
CID 131206927
(2S)-2-amino-N-(4-methylpentan-2-yl)butanamide
CID 79025012
3-(2-aminobutanoylamino)butanoic acid
CID 61159852
(2R)-2-[[(2R)-2-aminobutanoyl]amino]-4-hydroxybutanoic acid
CID 107825073
2-amino-N-octan-2-ylbutanamide
CID 43711439
2-amino-N-(4-ethylsulfanylbutan-2-yl)butanamide
CID 115734470
2-amino-N-(1-hydroxy-4,4-dimethylpentan-3-yl)butanamide
CID 106349899
(2R)-2-amino-N-[1-(dimethylamino)propan-2-yl]butanamide
CID 82945905
2-amino-N-(1,3-dihydroxypropan-2-yl)butanamide
CID 65314270
(2S)-2-amino-N-(3-ethylpentan-2-yl)butanamide
CID 79023204

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(4-hydroxybutan-2-yl)butanamide?
The IUPAC name of (2R)-2-amino-N-(4-hydroxybutan-2-yl)butanamide (CID 83177321) is (2R)-2-amino-N-(4-hydroxybutan-2-yl)butanamide.
What is the SMILES notation for (2R)-2-amino-N-(4-hydroxybutan-2-yl)butanamide?
The canonical SMILES for (2R)-2-amino-N-(4-hydroxybutan-2-yl)butanamide is CC[C@@H](N)C(=O)NC(C)CCO.
What is the InChIKey of (2R)-2-amino-N-(4-hydroxybutan-2-yl)butanamide?
The InChIKey is WVJCZXSJMFNEQK-COBSHVIPSA-N. The full InChI is InChI=1S/C8H18N2O2/c1-3-7(9)8(12)10-6(2)4-5-11/h6-7,11H,3-5,9H2,1-2H3,(H,10,12)/t6?,7-/m1/s1.
What are the key properties of (2R)-2-amino-N-(4-hydroxybutan-2-yl)butanamide?
(2R)-2-amino-N-(4-hydroxybutan-2-yl)butanamide has a molecular weight of 174.24 g/mol, XLogP of -0.39, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(4-hydroxybutan-2-yl)butanamide is sourced from PubChem (CID 83177321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).