2-(3-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]imidazol-4-yl)acetic acid

C11H16N2O2 — CID 83883899

IUPAC2-(3-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]imidazol-4-yl)acetic acid
SMILESCC(C)n1cnc2c1C(CC(=O)O)CC2
InChIInChI=1S/C11H16N2O2/c1-7(2)13-6-12-9-4-3-8(11(9)13)5-10(14)15/h6-8H,3-5H2,1-2H3,(H,14,15)
InChIKeyKEPFRJBYJXDLMV-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.97
Rot. Bonds3

About 2-(3-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]imidazol-4-yl)acetic acid

2-(3-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]imidazol-4-yl)acetic acid (PubChem CID 83883899) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-(3-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]imidazol-4-yl)acetic acid.

Molecular Properties

Compound Name2-(3-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]imidazol-4-yl)acetic acid
PubChem CID83883899
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name2-(3-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]imidazol-4-yl)acetic acid
SMILESCC(C)n1cnc2c1C(CC(=O)O)CC2
InChIInChI=1S/C11H16N2O2/c1-7(2)13-6-12-9-4-3-8(11(9)13)5-10(14)15/h6-8H,3-5H2,1-2H3,(H,14,15)
InChIKeyKEPFRJBYJXDLMV-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

3-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]imidazol-4-amine
CID 83873386
2-(1-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-5-yl)acetic acid
CID 82395342
2-(5,6-dihydro-4H-cyclopenta[c][1,2]thiazol-4-yl)acetic acid
CID 82407160
2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)acetic acid
CID 79740284
cyclopropyl-[4-(ethoxymethyl)-3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl]methanone
CID 118739079
2-(3-ethyl-4,5,6,7-tetrahydrobenzotriazol-4-yl)acetic acid
CID 84722839
[3,5-di(propan-2-yl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-4-yl]-(4-methylpiperazin-1-yl)methanone
CID 118738867
2-(5,6-dihydro-4H-cyclopenta[c][1,2]thiazol-6-yl)acetic acid
CID 82407162
(5-benzyl-3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-4-yl)-[4-(dimethylamino)piperidin-1-yl]methanone
CID 134075343
2-(1-propan-2-yl-4,5,6,7-tetrahydrobenzotriazol-4-yl)acetic acid
CID 83891238
cyclopropyl-(3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone
CID 110872742
[(4S)-5-benzyl-3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-4-yl]-(4-propan-2-ylpiperazin-1-yl)methanone
CID 97361571

Frequently Asked Questions

What is the IUPAC name of 2-(3-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]imidazol-4-yl)acetic acid?
The IUPAC name of 2-(3-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]imidazol-4-yl)acetic acid (CID 83883899) is 2-(3-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]imidazol-4-yl)acetic acid.
What is the SMILES notation for 2-(3-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]imidazol-4-yl)acetic acid?
The canonical SMILES for 2-(3-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]imidazol-4-yl)acetic acid is CC(C)n1cnc2c1C(CC(=O)O)CC2.
What is the InChIKey of 2-(3-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]imidazol-4-yl)acetic acid?
The InChIKey is KEPFRJBYJXDLMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-7(2)13-6-12-9-4-3-8(11(9)13)5-10(14)15/h6-8H,3-5H2,1-2H3,(H,14,15).
What are the key properties of 2-(3-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]imidazol-4-yl)acetic acid?
2-(3-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]imidazol-4-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-(3-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]imidazol-4-yl)acetic acid is sourced from PubChem (CID 83883899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).