(2S)-2-amino-N-methylpropanamide;hydrochloride

C4H11ClN2O — CID 18595779

IUPAC(2S)-2-amino-N-methylpropanamide;hydrochloride
SMILESCNC(=O)[C@H](C)N.Cl
InChIInChI=1S/C4H10N2O.ClH/c1-3(5)4(7)6-2;/h3H,5H2,1-2H3,(H,6,7);1H/t3-;/m0./s1
InChIKeyUHWFDFLWTAIHRE-DFWYDOINSA-N
MW138.60 g/mol
LogP-0.50
Rot. Bonds1

About (2S)-2-amino-N-methylpropanamide;hydrochloride

(2S)-2-amino-N-methylpropanamide;hydrochloride (PubChem CID 18595779) has the molecular formula C4H11ClN2O and a molecular weight of 138.60 g/mol. Its IUPAC name is (2S)-2-amino-N-methylpropanamide;hydrochloride.

Molecular Properties

Compound Name(2S)-2-amino-N-methylpropanamide;hydrochloride
PubChem CID18595779
Molecular FormulaC4H11ClN2O
Molecular Weight138.60 g/mol
Exact Mass138.06
IUPAC Name(2S)-2-amino-N-methylpropanamide;hydrochloride
SMILESCNC(=O)[C@H](C)N.Cl
InChIInChI=1S/C4H10N2O.ClH/c1-3(5)4(7)6-2;/h3H,5H2,1-2H3,(H,6,7);1H/t3-;/m0./s1
InChIKeyUHWFDFLWTAIHRE-DFWYDOINSA-N
XLogP-0.50
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.60
LogP ≤ 5-0.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

L-Alanylglycinamide
CID 7019037
Glycyl-l-alaninamide
CID 7019077
2-((1-Hydroxyethylidene)amino)-N-methylpropanimidic acid
CID 141892
2-amino-N-propylacetamide
CID 4961985
2-((Propan-2-yl)amino)acetamide
CID 5152851
2-Amino-N-isopropylacetamide
CID 533849
2-Acetamidopropanamide
CID 152381
2-Amino-N-ethylpropanamide
CID 541608
N-(2-Aminoethyl)propanamide
CID 4551317
2-amino-N-propylpropanamide
CID 4962196
(r)-2-Amino-n-ethyl-propanamide
CID 7128991
N-Acetylalanyl-N-methylamide
CID 5484387

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-methylpropanamide;hydrochloride?
The IUPAC name of (2S)-2-amino-N-methylpropanamide;hydrochloride (CID 18595779) is (2S)-2-amino-N-methylpropanamide;hydrochloride.
What is the SMILES notation for (2S)-2-amino-N-methylpropanamide;hydrochloride?
The canonical SMILES for (2S)-2-amino-N-methylpropanamide;hydrochloride is CNC(=O)[C@H](C)N.Cl.
What is the InChIKey of (2S)-2-amino-N-methylpropanamide;hydrochloride?
The InChIKey is UHWFDFLWTAIHRE-DFWYDOINSA-N. The full InChI is InChI=1S/C4H10N2O.ClH/c1-3(5)4(7)6-2;/h3H,5H2,1-2H3,(H,6,7);1H/t3-;/m0./s1.
What are the key properties of (2S)-2-amino-N-methylpropanamide;hydrochloride?
(2S)-2-amino-N-methylpropanamide;hydrochloride has a molecular weight of 138.60 g/mol, XLogP of -0.50, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-methylpropanamide;hydrochloride is sourced from PubChem (CID 18595779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).