2-(cyclopenta-2,4-dien-1-ylidenemethyl)-1-methylimidazole

C10H10N2 — CID 25165781

IUPAC2-(cyclopenta-2,4-dien-1-ylidenemethyl)-1-methylimidazole
SMILESCn1ccnc1C=C1C=CC=C1
InChIInChI=1S/C10H10N2/c1-12-7-6-11-10(12)8-9-4-2-3-5-9/h2-8H,1H3
InChIKeyZEWPPPFWSWTSRQ-UHFFFAOYSA-N
MW158.20 g/mol
LogP1.93
Rot. Bonds1

About 2-(cyclopenta-2,4-dien-1-ylidenemethyl)-1-methylimidazole

2-(cyclopenta-2,4-dien-1-ylidenemethyl)-1-methylimidazole (PubChem CID 25165781) has the molecular formula C10H10N2 and a molecular weight of 158.20 g/mol. Its IUPAC name is 2-(cyclopenta-2,4-dien-1-ylidenemethyl)-1-methylimidazole.

Molecular Properties

Compound Name2-(cyclopenta-2,4-dien-1-ylidenemethyl)-1-methylimidazole
PubChem CID25165781
Molecular FormulaC10H10N2
Molecular Weight158.20 g/mol
Exact Mass158.08
IUPAC Name2-(cyclopenta-2,4-dien-1-ylidenemethyl)-1-methylimidazole
SMILESCn1ccnc1C=C1C=CC=C1
InChIInChI=1S/C10H10N2/c1-12-7-6-11-10(12)8-9-4-2-3-5-9/h2-8H,1H3
InChIKeyZEWPPPFWSWTSRQ-UHFFFAOYSA-N
XLogP1.93
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopenta-2,4-dien-1-ylidenemethyl)-1-methylimidazole?
The IUPAC name of 2-(cyclopenta-2,4-dien-1-ylidenemethyl)-1-methylimidazole (CID 25165781) is 2-(cyclopenta-2,4-dien-1-ylidenemethyl)-1-methylimidazole.
What is the SMILES notation for 2-(cyclopenta-2,4-dien-1-ylidenemethyl)-1-methylimidazole?
The canonical SMILES for 2-(cyclopenta-2,4-dien-1-ylidenemethyl)-1-methylimidazole is Cn1ccnc1C=C1C=CC=C1.
What is the InChIKey of 2-(cyclopenta-2,4-dien-1-ylidenemethyl)-1-methylimidazole?
The InChIKey is ZEWPPPFWSWTSRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2/c1-12-7-6-11-10(12)8-9-4-2-3-5-9/h2-8H,1H3.
What are the key properties of 2-(cyclopenta-2,4-dien-1-ylidenemethyl)-1-methylimidazole?
2-(cyclopenta-2,4-dien-1-ylidenemethyl)-1-methylimidazole has a molecular weight of 158.20 g/mol, XLogP of 1.93, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopenta-2,4-dien-1-ylidenemethyl)-1-methylimidazole is sourced from PubChem (CID 25165781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).