2-amino-2-cyclopropylacetic acid

C5H9NO2 — CID 4112250

IUPAC2-amino-2-cyclopropylacetic acid
SMILESNC(C(=O)O)C1CC1
InChIInChI=1S/C5H9NO2/c6-4(5(7)8)3-1-2-3/h3-4H,1-2,6H2,(H,7,8)
InChIKeyBUSBCPMSNBMUMT-UHFFFAOYSA-N
MW115.13 g/mol
LogP-0.19
Rot. Bonds2

About 2-amino-2-cyclopropylacetic acid

2-amino-2-cyclopropylacetic acid (PubChem CID 4112250) has the molecular formula C5H9NO2 and a molecular weight of 115.13 g/mol. Its IUPAC name is 2-amino-2-cyclopropylacetic acid.

Molecular Properties

Compound Name2-amino-2-cyclopropylacetic acid
PubChem CID4112250
Molecular FormulaC5H9NO2
Molecular Weight115.13 g/mol
Exact Mass115.06
IUPAC Name2-amino-2-cyclopropylacetic acid
SMILESNC(C(=O)O)C1CC1
InChIInChI=1S/C5H9NO2/c6-4(5(7)8)3-1-2-3/h3-4H,1-2,6H2,(H,7,8)
InChIKeyBUSBCPMSNBMUMT-UHFFFAOYSA-N
XLogP-0.19
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.13
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

L-Leucine
CID 6106
L-Isoleucine
CID 6306
D-Leucine
CID 439524
Alloisoleucine, DL-
CID 99288
2-Amino-3-methylpentanoic acid
CID 791
Leucine zwitterion
CID 7045798
L-Norvaline
CID 65098
D-Isoleucine
CID 76551
(2S,3S)-2-ammonio-3-methylpentanoate
CID 7043901
Alloisoleucine, D-
CID 94206
DL-leucine
CID 857
D-Norvaline
CID 439575

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-cyclopropylacetic acid?
The IUPAC name of 2-amino-2-cyclopropylacetic acid (CID 4112250) is 2-amino-2-cyclopropylacetic acid.
What is the SMILES notation for 2-amino-2-cyclopropylacetic acid?
The canonical SMILES for 2-amino-2-cyclopropylacetic acid is NC(C(=O)O)C1CC1.
What is the InChIKey of 2-amino-2-cyclopropylacetic acid?
The InChIKey is BUSBCPMSNBMUMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO2/c6-4(5(7)8)3-1-2-3/h3-4H,1-2,6H2,(H,7,8).
What are the key properties of 2-amino-2-cyclopropylacetic acid?
2-amino-2-cyclopropylacetic acid has a molecular weight of 115.13 g/mol, XLogP of -0.19, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-cyclopropylacetic acid is sourced from PubChem (CID 4112250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).