1-methyl-2-[(Z)-(3-methylcyclopentylidene)methyl]imidazole

C11H16N2 — CID 23257778

IUPAC1-methyl-2-[(Z)-(3-methylcyclopentylidene)methyl]imidazole
SMILESCC1CC/C(=C/c2nccn2C)C1
InChIInChI=1S/C11H16N2/c1-9-3-4-10(7-9)8-11-12-5-6-13(11)2/h5-6,8-9H,3-4,7H2,1-2H3/b10-8-
InChIKeyWPGSTXRRZCIHIJ-NTMALXAHSA-N
MW176.26 g/mol
LogP2.62
Rot. Bonds1

About 1-methyl-2-[(Z)-(3-methylcyclopentylidene)methyl]imidazole

1-methyl-2-[(Z)-(3-methylcyclopentylidene)methyl]imidazole (PubChem CID 23257778) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is 1-methyl-2-[(Z)-(3-methylcyclopentylidene)methyl]imidazole.

Molecular Properties

Compound Name1-methyl-2-[(Z)-(3-methylcyclopentylidene)methyl]imidazole
PubChem CID23257778
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name1-methyl-2-[(Z)-(3-methylcyclopentylidene)methyl]imidazole
SMILESCC1CC/C(=C/c2nccn2C)C1
InChIInChI=1S/C11H16N2/c1-9-3-4-10(7-9)8-11-12-5-6-13(11)2/h5-6,8-9H,3-4,7H2,1-2H3/b10-8-
InChIKeyWPGSTXRRZCIHIJ-NTMALXAHSA-N
XLogP2.62
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-Subsituted 1H-imidazole, 14
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1-methyl-2-[(1E,5Z)-octa-1,5-dienyl]imidazole
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2-[(Z)-(2-ethylcyclopentylidene)methyl]-1-methylimidazole
CID 10987073
N-geranylimidazol
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rac-(3aR,7aS)-2-[2-(2-ethyl-1H-imidazol-1-yl)-1-methylethyl]-2,3,3a,4,7,7a-hexahydro-1H-isoindole
CID 132409145
(2S)-N-(2-imidazol-1-ylethyl)-N,6-dimethylhept-5-en-2-amine
CID 164642173
1-[(4-Cyclopentyl-4-fluorocyclohexa-1,5-dien-1-yl)methyl]imidazole
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2-(Cyclohexen-1-yl)-1-methylimidazole
CID 44195338
1-Methyl-2-[3-(1-methylimidazol-2-yl)cyclohex-3-en-1-yl]imidazole
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1-Methyl-3-[2,6-(s)-dimethyloctene-2-yl]imidazolium tetrafluoroborate
CID 129770363

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-[(Z)-(3-methylcyclopentylidene)methyl]imidazole?
The IUPAC name of 1-methyl-2-[(Z)-(3-methylcyclopentylidene)methyl]imidazole (CID 23257778) is 1-methyl-2-[(Z)-(3-methylcyclopentylidene)methyl]imidazole.
What is the SMILES notation for 1-methyl-2-[(Z)-(3-methylcyclopentylidene)methyl]imidazole?
The canonical SMILES for 1-methyl-2-[(Z)-(3-methylcyclopentylidene)methyl]imidazole is CC1CC/C(=C/c2nccn2C)C1.
What is the InChIKey of 1-methyl-2-[(Z)-(3-methylcyclopentylidene)methyl]imidazole?
The InChIKey is WPGSTXRRZCIHIJ-NTMALXAHSA-N. The full InChI is InChI=1S/C11H16N2/c1-9-3-4-10(7-9)8-11-12-5-6-13(11)2/h5-6,8-9H,3-4,7H2,1-2H3/b10-8-.
What are the key properties of 1-methyl-2-[(Z)-(3-methylcyclopentylidene)methyl]imidazole?
1-methyl-2-[(Z)-(3-methylcyclopentylidene)methyl]imidazole has a molecular weight of 176.26 g/mol, XLogP of 2.62, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[(Z)-(3-methylcyclopentylidene)methyl]imidazole is sourced from PubChem (CID 23257778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).