2-[3-(cyclobutylamino)azetidin-3-yl]acetic acid

C9H16N2O2 — CID 107142652

IUPAC2-[3-(cyclobutylamino)azetidin-3-yl]acetic acid
SMILESO=C(O)CC1(NC2CCC2)CNC1
InChIInChI=1S/C9H16N2O2/c12-8(13)4-9(5-10-6-9)11-7-2-1-3-7/h7,10-11H,1-6H2,(H,12,13)
InChIKeyKVOVLWNEHPGQHU-UHFFFAOYSA-N
MW184.24 g/mol
LogP-0.05
Rot. Bonds4

About 2-[3-(cyclobutylamino)azetidin-3-yl]acetic acid

2-[3-(cyclobutylamino)azetidin-3-yl]acetic acid (PubChem CID 107142652) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is 2-[3-(cyclobutylamino)azetidin-3-yl]acetic acid.

Molecular Properties

Compound Name2-[3-(cyclobutylamino)azetidin-3-yl]acetic acid
PubChem CID107142652
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC Name2-[3-(cyclobutylamino)azetidin-3-yl]acetic acid
SMILESO=C(O)CC1(NC2CCC2)CNC1
InChIInChI=1S/C9H16N2O2/c12-8(13)4-9(5-10-6-9)11-7-2-1-3-7/h7,10-11H,1-6H2,(H,12,13)
InChIKeyKVOVLWNEHPGQHU-UHFFFAOYSA-N
XLogP-0.05
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 5-0.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-(thian-4-ylamino)azetidin-3-yl]acetic acid
CID 107143163
2-[3-(oxan-4-ylamino)azetidin-3-yl]acetic acid
CID 107142370
2-[1-(cyclopentylamino)cyclopentyl]acetic acid
CID 82933315
2-[3-[(2,2,3,3-tetramethylcyclopropyl)amino]azetidin-3-yl]acetic acid
CID 107142855
2-[3-(2,3-dihydro-1H-inden-2-ylamino)azetidin-3-yl]acetic acid
CID 107853795
2-[3-[(2-methyloxolan-3-yl)amino]azetidin-3-yl]acetic acid
CID 107142991
2-[3-[(4-hydroxycyclohexyl)methylamino]azetidin-3-yl]acetic acid
CID 106137098
2-[3-(thian-2-ylmethylamino)azetidin-3-yl]acetic acid
CID 107142886
2-[1-(cyclobutylcarbamoylamino)cyclobutyl]acetic acid
CID 79851699
2-[3-(3-methylbutan-2-ylamino)azetidin-3-yl]acetic acid
CID 107142077
2-[3-[(1-methylpiperidin-3-yl)methylamino]azetidin-3-yl]acetic acid
CID 107142490
2-[1-[(2-pyrrolidin-3-ylacetyl)amino]cyclobutyl]acetic acid
CID 79845652

Frequently Asked Questions

What is the IUPAC name of 2-[3-(cyclobutylamino)azetidin-3-yl]acetic acid?
The IUPAC name of 2-[3-(cyclobutylamino)azetidin-3-yl]acetic acid (CID 107142652) is 2-[3-(cyclobutylamino)azetidin-3-yl]acetic acid.
What is the SMILES notation for 2-[3-(cyclobutylamino)azetidin-3-yl]acetic acid?
The canonical SMILES for 2-[3-(cyclobutylamino)azetidin-3-yl]acetic acid is O=C(O)CC1(NC2CCC2)CNC1.
What is the InChIKey of 2-[3-(cyclobutylamino)azetidin-3-yl]acetic acid?
The InChIKey is KVOVLWNEHPGQHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c12-8(13)4-9(5-10-6-9)11-7-2-1-3-7/h7,10-11H,1-6H2,(H,12,13).
What are the key properties of 2-[3-(cyclobutylamino)azetidin-3-yl]acetic acid?
2-[3-(cyclobutylamino)azetidin-3-yl]acetic acid has a molecular weight of 184.24 g/mol, XLogP of -0.05, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(cyclobutylamino)azetidin-3-yl]acetic acid is sourced from PubChem (CID 107142652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).