2-(2-methylpropanoylamino)acetic acid

C6H11NO3 — CID 10855600

IUPAC2-(2-methylpropanoylamino)acetic acid
SMILESCC(C)C(=O)NCC(=O)O
InChIInChI=1S/C6H11NO3/c1-4(2)6(10)7-3-5(8)9/h4H,3H2,1-2H3,(H,7,10)(H,8,9)
InChIKeyDCICDMMXFIELDF-UHFFFAOYSA-N
MW145.16 g/mol
LogP-0.16
Rot. Bonds3

About 2-(2-methylpropanoylamino)acetic acid

2-(2-methylpropanoylamino)acetic acid (PubChem CID 10855600) has the molecular formula C6H11NO3 and a molecular weight of 145.16 g/mol. Its IUPAC name is 2-(2-methylpropanoylamino)acetic acid.

Molecular Properties

Compound Name2-(2-methylpropanoylamino)acetic acid
PubChem CID10855600
Molecular FormulaC6H11NO3
Molecular Weight145.16 g/mol
Exact Mass145.07
IUPAC Name2-(2-methylpropanoylamino)acetic acid
SMILESCC(C)C(=O)NCC(=O)O
InChIInChI=1S/C6H11NO3/c1-4(2)6(10)7-3-5(8)9/h4H,3H2,1-2H3,(H,7,10)(H,8,9)
InChIKeyDCICDMMXFIELDF-UHFFFAOYSA-N
XLogP-0.16
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpropanoylamino)acetic acid?
The IUPAC name of 2-(2-methylpropanoylamino)acetic acid (CID 10855600) is 2-(2-methylpropanoylamino)acetic acid.
What is the SMILES notation for 2-(2-methylpropanoylamino)acetic acid?
The canonical SMILES for 2-(2-methylpropanoylamino)acetic acid is CC(C)C(=O)NCC(=O)O.
What is the InChIKey of 2-(2-methylpropanoylamino)acetic acid?
The InChIKey is DCICDMMXFIELDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO3/c1-4(2)6(10)7-3-5(8)9/h4H,3H2,1-2H3,(H,7,10)(H,8,9).
What are the key properties of 2-(2-methylpropanoylamino)acetic acid?
2-(2-methylpropanoylamino)acetic acid has a molecular weight of 145.16 g/mol, XLogP of -0.16, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpropanoylamino)acetic acid is sourced from PubChem (CID 10855600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).