2-[methyl-[2-(methylamino)propanoyl]amino]acetic acid

C7H14N2O3 — CID 62638787

IUPAC2-[methyl-[2-(methylamino)propanoyl]amino]acetic acid
SMILESCNC(C)C(=O)N(C)CC(=O)O
InChIInChI=1S/C7H14N2O3/c1-5(8-2)7(12)9(3)4-6(10)11/h5,8H,4H2,1-3H3,(H,10,11)
InChIKeyAWKQVYAHONOYOX-UHFFFAOYSA-N
MW174.20 g/mol
LogP-0.86
Rot. Bonds4

About 2-[methyl-[2-(methylamino)propanoyl]amino]acetic acid

2-[methyl-[2-(methylamino)propanoyl]amino]acetic acid (PubChem CID 62638787) has the molecular formula C7H14N2O3 and a molecular weight of 174.20 g/mol. Its IUPAC name is 2-[methyl-[2-(methylamino)propanoyl]amino]acetic acid.

Molecular Properties

Compound Name2-[methyl-[2-(methylamino)propanoyl]amino]acetic acid
PubChem CID62638787
Molecular FormulaC7H14N2O3
Molecular Weight174.20 g/mol
Exact Mass174.10
IUPAC Name2-[methyl-[2-(methylamino)propanoyl]amino]acetic acid
SMILESCNC(C)C(=O)N(C)CC(=O)O
InChIInChI=1S/C7H14N2O3/c1-5(8-2)7(12)9(3)4-6(10)11/h5,8H,4H2,1-3H3,(H,10,11)
InChIKeyAWKQVYAHONOYOX-UHFFFAOYSA-N
XLogP-0.86
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 5-0.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methyl-2-(methylamino)propanamide
CID 62638065
2-[[(2R)-2-aminopropanoyl]-methylamino]acetic acid;hydrochloride
CID 88764935
N-(cyclobutylmethyl)-N-methyl-2-(methylamino)propanamide
CID 62861176
2-[(2,2-dichloroacetyl)-methylamino]acetic acid
CID 21402665
2-[[2-(carbamoylamino)-4-methylpentanoyl]-methylamino]acetic acid
CID 43356152
2-[N-[2-(methylamino)propanoyl]anilino]acetic acid
CID 62638791
2-[(2-hydroxy-3,3-dimethylbutanoyl)-methylamino]acetic acid
CID 139777185
N-methyl-2-(methylamino)-N-(2-methylbutan-2-yl)propanamide
CID 63966379
2-[4-methyl-N-[2-(methylamino)propanoyl]anilino]acetic acid
CID 62638790
N-cyclopropyl-N-methyl-2-(methylamino)propanamide
CID 62637829
2-amino-N-methyl-N-[2-(methylamino)-2-oxoethyl]propanamide
CID 43375282
2-[methyl(methylcarbamothioyl)amino]acetic acid
CID 14685968

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[2-(methylamino)propanoyl]amino]acetic acid?
The IUPAC name of 2-[methyl-[2-(methylamino)propanoyl]amino]acetic acid (CID 62638787) is 2-[methyl-[2-(methylamino)propanoyl]amino]acetic acid.
What is the SMILES notation for 2-[methyl-[2-(methylamino)propanoyl]amino]acetic acid?
The canonical SMILES for 2-[methyl-[2-(methylamino)propanoyl]amino]acetic acid is CNC(C)C(=O)N(C)CC(=O)O.
What is the InChIKey of 2-[methyl-[2-(methylamino)propanoyl]amino]acetic acid?
The InChIKey is AWKQVYAHONOYOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O3/c1-5(8-2)7(12)9(3)4-6(10)11/h5,8H,4H2,1-3H3,(H,10,11).
What are the key properties of 2-[methyl-[2-(methylamino)propanoyl]amino]acetic acid?
2-[methyl-[2-(methylamino)propanoyl]amino]acetic acid has a molecular weight of 174.20 g/mol, XLogP of -0.86, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[2-(methylamino)propanoyl]amino]acetic acid is sourced from PubChem (CID 62638787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).