2-aminoacetic acid;bicyclo[3.1.0]hexa-1(6),2,4-triene

C8H9NO2 — CID 118514056

IUPAC2-aminoacetic acid;bicyclo[3.1.0]hexa-1(6),2,4-triene
SMILESNCC(=O)O.c1cc2cc-2c1
InChIInChI=1S/C6H4.C2H5NO2/c1-2-5-4-6(5)3-1;3-1-2(4)5/h1-4H;1,3H2,(H,4,5)
InChIKeyQRZSRVHFLOUOBD-UHFFFAOYSA-N
MW151.16 g/mol
LogP0.70
Rot. Bonds1

About 2-aminoacetic acid;bicyclo[3.1.0]hexa-1(6),2,4-triene

2-aminoacetic acid;bicyclo[3.1.0]hexa-1(6),2,4-triene (PubChem CID 118514056) has the molecular formula C8H9NO2 and a molecular weight of 151.16 g/mol. Its IUPAC name is 2-aminoacetic acid;bicyclo[3.1.0]hexa-1(6),2,4-triene.

Molecular Properties

Compound Name2-aminoacetic acid;bicyclo[3.1.0]hexa-1(6),2,4-triene
PubChem CID118514056
Molecular FormulaC8H9NO2
Molecular Weight151.16 g/mol
Exact Mass151.06
IUPAC Name2-aminoacetic acid;bicyclo[3.1.0]hexa-1(6),2,4-triene
SMILESNCC(=O)O.c1cc2cc-2c1
InChIInChI=1S/C6H4.C2H5NO2/c1-2-5-4-6(5)3-1;3-1-2(4)5/h1-4H;1,3H2,(H,4,5)
InChIKeyQRZSRVHFLOUOBD-UHFFFAOYSA-N
XLogP0.70
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-aminoacetic acid;1,1'-biphenyl
CID 22134128
azane;bicyclo[3.1.0]hexa-1(6),2,4-triene;2-hydroxyacetamide
CID 22413927
1-amino-3-(3-phenylphenyl)propan-2-one
CID 161234923
bicyclo[3.1.0]hexa-1(6),2,4-triene;2-oxopropanoic acid
CID 174739505
bicyclo[3.1.0]hexa-1(6),2,4-triene;methanediol
CID 175364747
2-amino-3-hydroxypropanoic acid;bicyclo[3.1.0]hexa-1(6),2,4-triene
CID 70461893
2-[3-[3-(2-aminoethyl)phenyl]phenyl]acetic acid
CID 1392718
2-aminopentanedioic acid;bicyclo[3.1.0]hexa-1(6),2,4-triene;hydrazine
CID 70434290
3-[3-(3-carboxyphenyl)phenyl]benzoic acid
CID 12023925
bicyclo[3.1.0]hexa-1(6),2,4-triene;3-hydroxy-2-methylpropanoic acid
CID 175519098
4-[3-(2-aminoacetyl)phenyl]benzoic acid
CID 170860911
2-[2-(aminomethyl)-5-phenylphenyl]acetic acid
CID 67211965

Frequently Asked Questions

What is the IUPAC name of 2-aminoacetic acid;bicyclo[3.1.0]hexa-1(6),2,4-triene?
The IUPAC name of 2-aminoacetic acid;bicyclo[3.1.0]hexa-1(6),2,4-triene (CID 118514056) is 2-aminoacetic acid;bicyclo[3.1.0]hexa-1(6),2,4-triene.
What is the SMILES notation for 2-aminoacetic acid;bicyclo[3.1.0]hexa-1(6),2,4-triene?
The canonical SMILES for 2-aminoacetic acid;bicyclo[3.1.0]hexa-1(6),2,4-triene is NCC(=O)O.c1cc2cc-2c1.
What is the InChIKey of 2-aminoacetic acid;bicyclo[3.1.0]hexa-1(6),2,4-triene?
The InChIKey is QRZSRVHFLOUOBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4.C2H5NO2/c1-2-5-4-6(5)3-1;3-1-2(4)5/h1-4H;1,3H2,(H,4,5).
What are the key properties of 2-aminoacetic acid;bicyclo[3.1.0]hexa-1(6),2,4-triene?
2-aminoacetic acid;bicyclo[3.1.0]hexa-1(6),2,4-triene has a molecular weight of 151.16 g/mol, XLogP of 0.70, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoacetic acid;bicyclo[3.1.0]hexa-1(6),2,4-triene is sourced from PubChem (CID 118514056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).