(3S)-4-amino-3-hydroxybutanamide

C4H10N2O2 — CID 12536775

IUPAC(3S)-4-amino-3-hydroxybutanamide
SMILESNC[C@@H](O)CC(N)=O
InChIInChI=1S/C4H10N2O2/c5-2-3(7)1-4(6)8/h3,7H,1-2,5H2,(H2,6,8)/t3-/m0/s1
InChIKeyVNVOVOGNNMKSTF-VKHMYHEASA-N
MW118.14 g/mol
LogP-1.82
Rot. Bonds3

About (3S)-4-amino-3-hydroxybutanamide

(3S)-4-amino-3-hydroxybutanamide (PubChem CID 12536775) has the molecular formula C4H10N2O2 and a molecular weight of 118.14 g/mol. Its IUPAC name is (3S)-4-amino-3-hydroxybutanamide.

Molecular Properties

Compound Name(3S)-4-amino-3-hydroxybutanamide
PubChem CID12536775
Molecular FormulaC4H10N2O2
Molecular Weight118.14 g/mol
Exact Mass118.07
IUPAC Name(3S)-4-amino-3-hydroxybutanamide
SMILESNC[C@@H](O)CC(N)=O
InChIInChI=1S/C4H10N2O2/c5-2-3(7)1-4(6)8/h3,7H,1-2,5H2,(H2,6,8)/t3-/m0/s1
InChIKeyVNVOVOGNNMKSTF-VKHMYHEASA-N
XLogP-1.82
TPSA89.34 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.14
LogP ≤ 5-1.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-4-amino-3-hydroxybutanamide;(3R)-3-hydroxypentanamide
CID 161102604
(3S)-7-amino-3-hydroxyheptanamide
CID 15916893
3,5-dihydroxypentanamide
CID 90721259
3-hydroxypentanamide;hydrochloride
CID 174591125
(3-amino-2-hydroxypropyl) carbamate
CID 87536011
8-amino-3-hydroxyoctanamide
CID 22149893
3,4-diaminobutanamide
CID 66426891
8-amino-3-hydroxyoctanamide;hydrochloride
CID 22149892
(4-amino-2-hydroxy-4-oxobutyl)-trimethylazanium hydroxide
CID 15630699
2-(aminomethyl)butanediamide
CID 20502890
CID 175729762
CID 175729762
(2Z,4R)-5-amino-4-hydroxy-2-hydroxyiminopentanoic acid
CID 15030767

Frequently Asked Questions

What is the IUPAC name of (3S)-4-amino-3-hydroxybutanamide?
The IUPAC name of (3S)-4-amino-3-hydroxybutanamide (CID 12536775) is (3S)-4-amino-3-hydroxybutanamide.
What is the SMILES notation for (3S)-4-amino-3-hydroxybutanamide?
The canonical SMILES for (3S)-4-amino-3-hydroxybutanamide is NC[C@@H](O)CC(N)=O.
What is the InChIKey of (3S)-4-amino-3-hydroxybutanamide?
The InChIKey is VNVOVOGNNMKSTF-VKHMYHEASA-N. The full InChI is InChI=1S/C4H10N2O2/c5-2-3(7)1-4(6)8/h3,7H,1-2,5H2,(H2,6,8)/t3-/m0/s1.
What are the key properties of (3S)-4-amino-3-hydroxybutanamide?
(3S)-4-amino-3-hydroxybutanamide has a molecular weight of 118.14 g/mol, XLogP of -1.82, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-4-amino-3-hydroxybutanamide is sourced from PubChem (CID 12536775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).