2-(methylcarbamoylamino)acetic acid

C4H8N2O3 — CID 16786632

IUPAC2-(methylcarbamoylamino)acetic acid
SMILESCNC(=O)NCC(=O)O
InChIInChI=1S/C4H8N2O3/c1-5-4(9)6-2-3(7)8/h2H2,1H3,(H,7,8)(H2,5,6,9)
InChIKeyJBGKTLCSARFDPE-UHFFFAOYSA-N
MW132.12 g/mol
LogP-1.00
Rot. Bonds2

About 2-(methylcarbamoylamino)acetic acid

2-(methylcarbamoylamino)acetic acid (PubChem CID 16786632) has the molecular formula C4H8N2O3 and a molecular weight of 132.12 g/mol. Its IUPAC name is 2-(methylcarbamoylamino)acetic acid.

Molecular Properties

Compound Name2-(methylcarbamoylamino)acetic acid
PubChem CID16786632
Molecular FormulaC4H8N2O3
Molecular Weight132.12 g/mol
Exact Mass132.05
IUPAC Name2-(methylcarbamoylamino)acetic acid
SMILESCNC(=O)NCC(=O)O
InChIInChI=1S/C4H8N2O3/c1-5-4(9)6-2-3(7)8/h2H2,1H3,(H,7,8)(H2,5,6,9)
InChIKeyJBGKTLCSARFDPE-UHFFFAOYSA-N
XLogP-1.00
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.12
LogP ≤ 5-1.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

Hydantoic acid
CID 10020
Allantoic acid
CID 203
N-Carbamoylsarcosine
CID 439375
2-(Carbamoylamino)propanoic acid
CID 426409
(S)-2-ureidoglycine
CID 45479615
2-(3-Ethylureido)-2-oxoacetic acid
CID 3064870
(2S)-2-(carbamoylamino)propanoic acid
CID 1535936
N-Carbamoyl-Alanine
CID 1535935
(Diaminomethyl-Methyl-Amino)-Acetic Acid
CID 4635864
Glycine, N-((butylamino)carbonyl)-
CID 112991
1,6,8-Trimethylallantoate
CID 122706624
2-Ureidoglycine
CID 439649

Frequently Asked Questions

What is the IUPAC name of 2-(methylcarbamoylamino)acetic acid?
The IUPAC name of 2-(methylcarbamoylamino)acetic acid (CID 16786632) is 2-(methylcarbamoylamino)acetic acid.
What is the SMILES notation for 2-(methylcarbamoylamino)acetic acid?
The canonical SMILES for 2-(methylcarbamoylamino)acetic acid is CNC(=O)NCC(=O)O.
What is the InChIKey of 2-(methylcarbamoylamino)acetic acid?
The InChIKey is JBGKTLCSARFDPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N2O3/c1-5-4(9)6-2-3(7)8/h2H2,1H3,(H,7,8)(H2,5,6,9).
What are the key properties of 2-(methylcarbamoylamino)acetic acid?
2-(methylcarbamoylamino)acetic acid has a molecular weight of 132.12 g/mol, XLogP of -1.00, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylcarbamoylamino)acetic acid is sourced from PubChem (CID 16786632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).