2-amino-2-cyclopropyl-3-[cyclopropyl(ethyl)amino]propanoic acid

C11H20N2O2 — CID 63909323

IUPAC2-amino-2-cyclopropyl-3-[cyclopropyl(ethyl)amino]propanoic acid
SMILESCCN(CC(N)(C(=O)O)C1CC1)C1CC1
InChIInChI=1S/C11H20N2O2/c1-2-13(9-5-6-9)7-11(12,10(14)15)8-3-4-8/h8-9H,2-7,12H2,1H3,(H,14,15)
InChIKeyJXSRNJTUVIWKPR-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.66
Rot. Bonds6

About 2-amino-2-cyclopropyl-3-[cyclopropyl(ethyl)amino]propanoic acid

2-amino-2-cyclopropyl-3-[cyclopropyl(ethyl)amino]propanoic acid (PubChem CID 63909323) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 2-amino-2-cyclopropyl-3-[cyclopropyl(ethyl)amino]propanoic acid.

Molecular Properties

Compound Name2-amino-2-cyclopropyl-3-[cyclopropyl(ethyl)amino]propanoic acid
PubChem CID63909323
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name2-amino-2-cyclopropyl-3-[cyclopropyl(ethyl)amino]propanoic acid
SMILESCCN(CC(N)(C(=O)O)C1CC1)C1CC1
InChIInChI=1S/C11H20N2O2/c1-2-13(9-5-6-9)7-11(12,10(14)15)8-3-4-8/h8-9H,2-7,12H2,1H3,(H,14,15)
InChIKeyJXSRNJTUVIWKPR-UHFFFAOYSA-N
XLogP0.66
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-2-cyclopropyl-3-(diethylamino)propanoic acid
CID 63907227
methyl 2-amino-3-[cyclopentyl(ethyl)amino]-2-cyclopropylpropanoate
CID 63911302
ethyl 2-amino-3-[cyclohexyl(ethyl)amino]-2-cyclopropylpropanoate
CID 63908666
2-amino-2-cyclopropyl-3-[cyclopropyl(ethyl)amino]propan-1-ol
CID 64796590
2-amino-2-cyclopropyl-3-[methyl(pentyl)amino]propanoic acid
CID 63910898
2-amino-2-cyclopropyl-3-[methyl(4-methylpentan-2-yl)amino]propanoic acid
CID 63921885
2-cyclopropyl-3-[cyclopropyl(ethyl)amino]-2-(ethylamino)propanamide
CID 63911879
3-[cyclohexyl(ethyl)amino]-2-cyclopropyl-2-(methylamino)propanoic acid
CID 63906996
2-amino-2-cyclopropyl-3-(N-ethyl-3-methylanilino)propanoic acid
CID 63911523
4-[cyclopropyl(ethyl)amino]-2,2-dimethylbutanoic acid
CID 65248437
N-(2,2-dimethylpropyl)-N-ethylcyclopropanamine
CID 67816379
ethyl 2-cyclopropyl-2-(cyclopropylamino)-3-[cyclopropyl(ethyl)amino]propanoate
CID 63911878

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-cyclopropyl-3-[cyclopropyl(ethyl)amino]propanoic acid?
The IUPAC name of 2-amino-2-cyclopropyl-3-[cyclopropyl(ethyl)amino]propanoic acid (CID 63909323) is 2-amino-2-cyclopropyl-3-[cyclopropyl(ethyl)amino]propanoic acid.
What is the SMILES notation for 2-amino-2-cyclopropyl-3-[cyclopropyl(ethyl)amino]propanoic acid?
The canonical SMILES for 2-amino-2-cyclopropyl-3-[cyclopropyl(ethyl)amino]propanoic acid is CCN(CC(N)(C(=O)O)C1CC1)C1CC1.
What is the InChIKey of 2-amino-2-cyclopropyl-3-[cyclopropyl(ethyl)amino]propanoic acid?
The InChIKey is JXSRNJTUVIWKPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-2-13(9-5-6-9)7-11(12,10(14)15)8-3-4-8/h8-9H,2-7,12H2,1H3,(H,14,15).
What are the key properties of 2-amino-2-cyclopropyl-3-[cyclopropyl(ethyl)amino]propanoic acid?
2-amino-2-cyclopropyl-3-[cyclopropyl(ethyl)amino]propanoic acid has a molecular weight of 212.29 g/mol, XLogP of 0.66, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-cyclopropyl-3-[cyclopropyl(ethyl)amino]propanoic acid is sourced from PubChem (CID 63909323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).