2-[[2-(1-aminocyclobutyl)acetyl]amino]acetic acid

C8H14N2O3 — CID 79854186

IUPAC2-[[2-(1-aminocyclobutyl)acetyl]amino]acetic acid
SMILESNC1(CC(=O)NCC(=O)O)CCC1
InChIInChI=1S/C8H14N2O3/c9-8(2-1-3-8)4-6(11)10-5-7(12)13/h1-5,9H2,(H,10,11)(H,12,13)
InChIKeyOUSUMVUOXFLCRO-UHFFFAOYSA-N
MW186.21 g/mol
LogP-0.54
Rot. Bonds4

About 2-[[2-(1-aminocyclobutyl)acetyl]amino]acetic acid

2-[[2-(1-aminocyclobutyl)acetyl]amino]acetic acid (PubChem CID 79854186) has the molecular formula C8H14N2O3 and a molecular weight of 186.21 g/mol. Its IUPAC name is 2-[[2-(1-aminocyclobutyl)acetyl]amino]acetic acid.

Molecular Properties

Compound Name2-[[2-(1-aminocyclobutyl)acetyl]amino]acetic acid
PubChem CID79854186
Molecular FormulaC8H14N2O3
Molecular Weight186.21 g/mol
Exact Mass186.10
IUPAC Name2-[[2-(1-aminocyclobutyl)acetyl]amino]acetic acid
SMILESNC1(CC(=O)NCC(=O)O)CCC1
InChIInChI=1S/C8H14N2O3/c9-8(2-1-3-8)4-6(11)10-5-7(12)13/h1-5,9H2,(H,10,11)(H,12,13)
InChIKeyOUSUMVUOXFLCRO-UHFFFAOYSA-N
XLogP-0.54
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 5-0.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-aminocyclohexyl)-N-(2-amino-2-oxoethyl)acetamide
CID 64684917
2-(1-aminocyclopentyl)-N-[2-(methylamino)-2-oxoethyl]acetamide
CID 64686159
2-(1-aminocyclobutyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide
CID 112701652
2-(1-aminocyclobutyl)-N-(2-aminoethyl)acetamide
CID 79853853
2-[[2-[[2-[1-(aminomethyl)cyclobutyl]acetyl]amino]acetyl]amino]acetic acid
CID 81171912
2-(1-aminocyclopentyl)-N-[2-(dimethylamino)-2-oxoethyl]acetamide
CID 64686359
2-(1-aminocyclobutyl)-N-[2-(benzylamino)-2-oxoethyl]acetamide
CID 79854273
2-(1-aminocyclohexyl)-N-[2-(tert-butylamino)-2-oxoethyl]acetamide
CID 64684379
6-[[2-(1-aminocyclobutyl)acetyl]amino]-4-methylhexanoic acid
CID 79853883
2-(1-aminocyclobutyl)-N-[2-(dimethylamino)-2-methylpropyl]acetamide
CID 79854548
2-(1-aminocyclopentyl)-N-(2-methyl-2-methylsulfonylpropyl)acetamide
CID 79551122
2-[1-[[2-(1-aminocyclobutyl)acetyl]amino]cyclohexyl]acetic acid
CID 79854754

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(1-aminocyclobutyl)acetyl]amino]acetic acid?
The IUPAC name of 2-[[2-(1-aminocyclobutyl)acetyl]amino]acetic acid (CID 79854186) is 2-[[2-(1-aminocyclobutyl)acetyl]amino]acetic acid.
What is the SMILES notation for 2-[[2-(1-aminocyclobutyl)acetyl]amino]acetic acid?
The canonical SMILES for 2-[[2-(1-aminocyclobutyl)acetyl]amino]acetic acid is NC1(CC(=O)NCC(=O)O)CCC1.
What is the InChIKey of 2-[[2-(1-aminocyclobutyl)acetyl]amino]acetic acid?
The InChIKey is OUSUMVUOXFLCRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O3/c9-8(2-1-3-8)4-6(11)10-5-7(12)13/h1-5,9H2,(H,10,11)(H,12,13).
What are the key properties of 2-[[2-(1-aminocyclobutyl)acetyl]amino]acetic acid?
2-[[2-(1-aminocyclobutyl)acetyl]amino]acetic acid has a molecular weight of 186.21 g/mol, XLogP of -0.54, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(1-aminocyclobutyl)acetyl]amino]acetic acid is sourced from PubChem (CID 79854186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).