3-(dimethylamino)-2-hydroxypropanamide;hydrochloride

C5H13ClN2O2 — CID 89312207

IUPAC3-(dimethylamino)-2-hydroxypropanamide;hydrochloride
SMILESCN(C)CC(O)C(N)=O.Cl
InChIInChI=1S/C5H12N2O2.ClH/c1-7(2)3-4(8)5(6)9;/h4,8H,3H2,1-2H3,(H2,6,9);1H
InChIKeyZXTUFIJZPBPXCX-UHFFFAOYSA-N
MW168.62 g/mol
LogP-1.18
Rot. Bonds3

About 3-(dimethylamino)-2-hydroxypropanamide;hydrochloride

3-(dimethylamino)-2-hydroxypropanamide;hydrochloride (PubChem CID 89312207) has the molecular formula C5H13ClN2O2 and a molecular weight of 168.62 g/mol. Its IUPAC name is 3-(dimethylamino)-2-hydroxypropanamide;hydrochloride.

Molecular Properties

Compound Name3-(dimethylamino)-2-hydroxypropanamide;hydrochloride
PubChem CID89312207
Molecular FormulaC5H13ClN2O2
Molecular Weight168.62 g/mol
Exact Mass168.07
IUPAC Name3-(dimethylamino)-2-hydroxypropanamide;hydrochloride
SMILESCN(C)CC(O)C(N)=O.Cl
InChIInChI=1S/C5H12N2O2.ClH/c1-7(2)3-4(8)5(6)9;/h4,8H,3H2,1-2H3,(H2,6,9);1H
InChIKeyZXTUFIJZPBPXCX-UHFFFAOYSA-N
XLogP-1.18
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.62
LogP ≤ 5-1.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(dimethylamino)-2-hydroxy-N,N-dimethylpropanamide
CID 23815469
2-hydroxybutanamide;hydrochloride
CID 87384831
[3-(dimethylamino)-2-hydroxypropyl] carbamate
CID 87246058
(2S)-2-amino-3-(dimethylamino)propanoic acid;hydrate;dihydrochloride
CID 90471472
2-hydroxy-4-oxopentanamide
CID 54002232
2-[1-(dimethylamino)propan-2-yl-ethylamino]propanamide
CID 103190759
2-hydroxy-3-[[(2R)-2-hydroxypropyl]amino]propanamide
CID 106174936
4-(dimethylamino)-2-methylbutanamide;hydrochloride
CID 143130107
3-[[1-(dimethylamino)-1-oxopropan-2-yl]amino]-2-hydroxypropanamide
CID 106174475
4-amino-1-(dimethylamino)butan-2-ol;hydrochloride
CID 83967321
1-(dimethylamino)propan-2-ol;ethane-1,2-diamine
CID 174810904
2-[2-hydroxypropyl(methyl)amino]butanamide
CID 62901231

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-2-hydroxypropanamide;hydrochloride?
The IUPAC name of 3-(dimethylamino)-2-hydroxypropanamide;hydrochloride (CID 89312207) is 3-(dimethylamino)-2-hydroxypropanamide;hydrochloride.
What is the SMILES notation for 3-(dimethylamino)-2-hydroxypropanamide;hydrochloride?
The canonical SMILES for 3-(dimethylamino)-2-hydroxypropanamide;hydrochloride is CN(C)CC(O)C(N)=O.Cl.
What is the InChIKey of 3-(dimethylamino)-2-hydroxypropanamide;hydrochloride?
The InChIKey is ZXTUFIJZPBPXCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O2.ClH/c1-7(2)3-4(8)5(6)9;/h4,8H,3H2,1-2H3,(H2,6,9);1H.
What are the key properties of 3-(dimethylamino)-2-hydroxypropanamide;hydrochloride?
3-(dimethylamino)-2-hydroxypropanamide;hydrochloride has a molecular weight of 168.62 g/mol, XLogP of -1.18, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-2-hydroxypropanamide;hydrochloride is sourced from PubChem (CID 89312207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).