6-cyclopropylindolizine-2-carboxylic acid

C12H11NO2 — CID 139490633

IUPAC6-cyclopropylindolizine-2-carboxylic acid
SMILESO=C(O)c1cc2ccc(C3CC3)cn2c1
InChIInChI=1S/C12H11NO2/c14-12(15)10-5-11-4-3-9(8-1-2-8)6-13(11)7-10/h3-8H,1-2H2,(H,14,15)
InChIKeyHNXTZPFRINAOFB-UHFFFAOYSA-N
MW201.22 g/mol
LogP2.51
Rot. Bonds2

About 6-cyclopropylindolizine-2-carboxylic acid

6-cyclopropylindolizine-2-carboxylic acid (PubChem CID 139490633) has the molecular formula C12H11NO2 and a molecular weight of 201.22 g/mol. Its IUPAC name is 6-cyclopropylindolizine-2-carboxylic acid.

Molecular Properties

Compound Name6-cyclopropylindolizine-2-carboxylic acid
PubChem CID139490633
Molecular FormulaC12H11NO2
Molecular Weight201.22 g/mol
Exact Mass201.08
IUPAC Name6-cyclopropylindolizine-2-carboxylic acid
SMILESO=C(O)c1cc2ccc(C3CC3)cn2c1
InChIInChI=1S/C12H11NO2/c14-12(15)10-5-11-4-3-9(8-1-2-8)6-13(11)7-10/h3-8H,1-2H2,(H,14,15)
InChIKeyHNXTZPFRINAOFB-UHFFFAOYSA-N
XLogP2.51
TPSA41.71 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.22
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-aminoindolizine-2-carboxylic acid
CID 82410961
2-(4-cyclopropylphenyl)-2-oxoacetic acid
CID 117281739
4-(4-methylcyclohexyl)benzoic acid
CID 56632428
6-cyclobutylimidazo[1,2-a]pyridine-2-carboxylic acid
CID 139487962
4-(4-heptylcyclohexyl)benzoic acid
CID 12700035
2-cyclopropylimidazo[1,2-a]pyridine-6-carboxylic acid
CID 63906537
4-(1-methylazepan-4-yl)benzoic acid
CID 83841215
4-(4-carboxycyclohexyl)benzoic acid;4-(4-carboxycyclohexyl)cyclohexane-1-carboxylic acid;4-(4-carboxyphenyl)benzoic acid
CID 160674040
4-(4-cyclobutylphenyl)benzoic acid
CID 116506494
4-(1-benzylpiperidin-4-yl)benzoic acid
CID 125492559
2-[4-(4-tert-butylcyclohexyl)phenyl]-2-oxoacetic acid
CID 117466014
pyrrolo[1,2-b]pyridazine-6-carboxylic acid
CID 22473177

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropylindolizine-2-carboxylic acid?
The IUPAC name of 6-cyclopropylindolizine-2-carboxylic acid (CID 139490633) is 6-cyclopropylindolizine-2-carboxylic acid.
What is the SMILES notation for 6-cyclopropylindolizine-2-carboxylic acid?
The canonical SMILES for 6-cyclopropylindolizine-2-carboxylic acid is O=C(O)c1cc2ccc(C3CC3)cn2c1.
What is the InChIKey of 6-cyclopropylindolizine-2-carboxylic acid?
The InChIKey is HNXTZPFRINAOFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO2/c14-12(15)10-5-11-4-3-9(8-1-2-8)6-13(11)7-10/h3-8H,1-2H2,(H,14,15).
What are the key properties of 6-cyclopropylindolizine-2-carboxylic acid?
6-cyclopropylindolizine-2-carboxylic acid has a molecular weight of 201.22 g/mol, XLogP of 2.51, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropylindolizine-2-carboxylic acid is sourced from PubChem (CID 139490633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).