2-(1-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-5-yl)acetic acid

C11H16N2O2 — CID 82395342

IUPAC2-(1-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-5-yl)acetic acid
SMILESCC(C)c1ncn2c1CCC2CC(=O)O
InChIInChI=1S/C11H16N2O2/c1-7(2)11-9-4-3-8(5-10(14)15)13(9)6-12-11/h6-8H,3-5H2,1-2H3,(H,14,15)
InChIKeyFMBUXLGSDFKZDU-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.97
Rot. Bonds3

About 2-(1-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-5-yl)acetic acid

2-(1-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-5-yl)acetic acid (PubChem CID 82395342) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-(1-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-5-yl)acetic acid.

Molecular Properties

Compound Name2-(1-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-5-yl)acetic acid
PubChem CID82395342
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name2-(1-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-5-yl)acetic acid
SMILESCC(C)c1ncn2c1CCC2CC(=O)O
InChIInChI=1S/C11H16N2O2/c1-7(2)11-9-4-3-8(5-10(14)15)13(9)6-12-11/h6-8H,3-5H2,1-2H3,(H,14,15)
InChIKeyFMBUXLGSDFKZDU-UHFFFAOYSA-N
XLogP1.97
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazole-5-carboxylic acid
CID 82401160
ethyl 1-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-5-carboxylate
CID 176763750
2-(1-phenyl-3-propan-2-yl-4,5,6,7-tetrahydroindazol-4-yl)acetic acid
CID 82591522
2-(3-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]imidazol-4-yl)acetic acid
CID 83883899
3-cyclopropyl-5-propan-2-ylimidazol-4-amine
CID 62077490
2-[1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-yl]acetic acid
CID 82383599
2-(1-propan-2-yl-4,5,6,7-tetrahydrobenzotriazol-4-yl)acetic acid
CID 83891238
2-[1-(2-propan-2-ylpyrimidin-4-yl)piperidin-2-yl]acetic acid
CID 138030149
2-(1-bromo-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-yl)acetic acid
CID 83867591
2-(1-methyl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-5-yl)ethanamine
CID 82414433
2-[1-[1-(4-methyl-1,2,4-triazol-3-yl)ethylcarbamoyl]pyrrolidin-2-yl]acetic acid
CID 62118143
2-[1-[5-(2-methylpropyl)pyrimidin-2-yl]pyrrolidin-2-yl]acetic acid
CID 116976841

Frequently Asked Questions

What is the IUPAC name of 2-(1-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-5-yl)acetic acid?
The IUPAC name of 2-(1-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-5-yl)acetic acid (CID 82395342) is 2-(1-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-5-yl)acetic acid.
What is the SMILES notation for 2-(1-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-5-yl)acetic acid?
The canonical SMILES for 2-(1-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-5-yl)acetic acid is CC(C)c1ncn2c1CCC2CC(=O)O.
What is the InChIKey of 2-(1-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-5-yl)acetic acid?
The InChIKey is FMBUXLGSDFKZDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-7(2)11-9-4-3-8(5-10(14)15)13(9)6-12-11/h6-8H,3-5H2,1-2H3,(H,14,15).
What are the key properties of 2-(1-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-5-yl)acetic acid?
2-(1-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-5-yl)acetic acid has a molecular weight of 208.26 g/mol, XLogP of 1.97, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-5-yl)acetic acid is sourced from PubChem (CID 82395342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).