3-amino-2-cyclobutyl-2-cyclopropylpropanoic acid

C10H17NO2 — CID 106489641

IUPAC3-amino-2-cyclobutyl-2-cyclopropylpropanoic acid
SMILESNCC(C(=O)O)(C1CCC1)C1CC1
InChIInChI=1S/C10H17NO2/c11-6-10(9(12)13,8-4-5-8)7-2-1-3-7/h7-8H,1-6,11H2,(H,12,13)
InChIKeySYMYFRISXJSBLW-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.23
Rot. Bonds4

About 3-amino-2-cyclobutyl-2-cyclopropylpropanoic acid

3-amino-2-cyclobutyl-2-cyclopropylpropanoic acid (PubChem CID 106489641) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is 3-amino-2-cyclobutyl-2-cyclopropylpropanoic acid.

Molecular Properties

Compound Name3-amino-2-cyclobutyl-2-cyclopropylpropanoic acid
PubChem CID106489641
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name3-amino-2-cyclobutyl-2-cyclopropylpropanoic acid
SMILESNCC(C(=O)O)(C1CCC1)C1CC1
InChIInChI=1S/C10H17NO2/c11-6-10(9(12)13,8-4-5-8)7-2-1-3-7/h7-8H,1-6,11H2,(H,12,13)
InChIKeySYMYFRISXJSBLW-UHFFFAOYSA-N
XLogP1.23
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-2-cyclobutyl-2-methylpropanoic acid
CID 106487162
2,2-dicyclopropylbutanoic acid
CID 139618787
2-(aminomethyl)-2-cyclopentyl-3-fluorobutanoic acid
CID 105455433
2-(aminomethyl)-2-cyclopropyl-5-hydroxypentanoic acid
CID 106489638
2-(aminomethyl)-2-cyclopropyl-5-fluoropentanoic acid
CID 106489665
2-amino-2-cyclohexyl-2-fluoroacetic acid
CID 176668442
2-(aminomethyl)-2-cyclopropyl-8-hydroxyoctanoic acid
CID 107708251
2-(aminomethyl)-2-cycloheptylpentanoic acid
CID 106488140
2,2-di(cyclododecyl)dodecanedioic acid
CID 121470791
3-amino-2-cyclobutyl-2-(4-fluorophenyl)propanoic acid
CID 106490917
2-amino-2-cyclobutyl-3,3-difluoropropanoic acid
CID 105437833
carbonic acid;cyclohexane-1,3-diamine
CID 67563163

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-cyclobutyl-2-cyclopropylpropanoic acid?
The IUPAC name of 3-amino-2-cyclobutyl-2-cyclopropylpropanoic acid (CID 106489641) is 3-amino-2-cyclobutyl-2-cyclopropylpropanoic acid.
What is the SMILES notation for 3-amino-2-cyclobutyl-2-cyclopropylpropanoic acid?
The canonical SMILES for 3-amino-2-cyclobutyl-2-cyclopropylpropanoic acid is NCC(C(=O)O)(C1CCC1)C1CC1.
What is the InChIKey of 3-amino-2-cyclobutyl-2-cyclopropylpropanoic acid?
The InChIKey is SYMYFRISXJSBLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c11-6-10(9(12)13,8-4-5-8)7-2-1-3-7/h7-8H,1-6,11H2,(H,12,13).
What are the key properties of 3-amino-2-cyclobutyl-2-cyclopropylpropanoic acid?
3-amino-2-cyclobutyl-2-cyclopropylpropanoic acid has a molecular weight of 183.25 g/mol, XLogP of 1.23, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-cyclobutyl-2-cyclopropylpropanoic acid is sourced from PubChem (CID 106489641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).