5-(2-cyclohexyl-2-fluoroethyl)-7-methyl-6-[(Z)-prop-1-enyl]-5H-pyrrolo[1,2-c]imidazole

C18H25FN2 — CID 142611000

IUPAC5-(2-cyclohexyl-2-fluoroethyl)-7-methyl-6-[(Z)-prop-1-enyl]-5H-pyrrolo[1,2-c]imidazole
SMILESC/C=C\C1=C(C)c2cncn2C1CC(F)C1CCCCC1
InChIInChI=1S/C18H25FN2/c1-3-7-15-13(2)18-11-20-12-21(18)17(15)10-16(19)14-8-5-4-6-9-14/h3,7,11-12,14,16-17H,4-6,8-10H2,1-2H3/b7-3-
InChIKeyQWSSDQYFOSLEKY-CLTKARDFSA-N
MW288.41 g/mol
LogP5.10
Rot. Bonds4

About 5-(2-cyclohexyl-2-fluoroethyl)-7-methyl-6-[(Z)-prop-1-enyl]-5H-pyrrolo[1,2-c]imidazole

5-(2-cyclohexyl-2-fluoroethyl)-7-methyl-6-[(Z)-prop-1-enyl]-5H-pyrrolo[1,2-c]imidazole (PubChem CID 142611000) has the molecular formula C18H25FN2 and a molecular weight of 288.41 g/mol. Its IUPAC name is 5-(2-cyclohexyl-2-fluoroethyl)-7-methyl-6-[(Z)-prop-1-enyl]-5H-pyrrolo[1,2-c]imidazole.

Molecular Properties

Compound Name5-(2-cyclohexyl-2-fluoroethyl)-7-methyl-6-[(Z)-prop-1-enyl]-5H-pyrrolo[1,2-c]imidazole
PubChem CID142611000
Molecular FormulaC18H25FN2
Molecular Weight288.41 g/mol
Exact Mass288.20
IUPAC Name5-(2-cyclohexyl-2-fluoroethyl)-7-methyl-6-[(Z)-prop-1-enyl]-5H-pyrrolo[1,2-c]imidazole
SMILESC/C=C\C1=C(C)c2cncn2C1CC(F)C1CCCCC1
InChIInChI=1S/C18H25FN2/c1-3-7-15-13(2)18-11-20-12-21(18)17(15)10-16(19)14-8-5-4-6-9-14/h3,7,11-12,14,16-17H,4-6,8-10H2,1-2H3/b7-3-
InChIKeyQWSSDQYFOSLEKY-CLTKARDFSA-N
XLogP5.10
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500288.41
LogP ≤ 55.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-(2-cyclohexyl-2-fluoroethyl)-7-methyl-6-[(Z)-prop-1-enyl]-5H-pyrrolo[1,2-c]imidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(6-cyclohexa-1,5-dien-1-yl-4-fluorocyclohexa-1,3-dien-1-yl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine
CID 70822346
5-[6-[2-(trifluoromethyl)cyclohexa-1,5-dien-1-yl]cyclohexa-1,3-dien-1-yl]-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine
CID 70822381
7-[(1Z)-buta-1,3-dienyl]-5-[(2-cyclohexyl-1,3-dithian-2-yl)methyl]-6-fluoro-5H-pyrrolo[1,2-c]imidazole
CID 118931152
2-(6-fluoro-6H-imidazo[1,5-b]isoindol-5-yl)-2-(4-propan-2-ylidenecyclohexyl)ethanol
CID 123251202
5-(2-cyclohexyl-2-fluoroethyl)-7-methyl-6-phenyl-5H-pyrrolo[1,2-c]imidazole
CID 130300415
5-[2-(4,4-difluorocyclohexyl)ethyl]-7-methyl-6-phenyl-5H-pyrrolo[1,2-c]imidazole
CID 130300460
7-[(1Z)-buta-1,3-dienyl]-6-fluoro-5-[2-(1-fluorocyclohexyl)ethyl]-5H-pyrrolo[1,2-c]imidazole
CID 130455671
6-[(1Z)-buta-1,3-dienyl]-7-ethenyl-5-[2-(1-fluorocyclohexyl)ethyl]-5H-pyrrolo[1,2-c]imidazole
CID 130455674
5-(2-cyclohexyl-2-fluoroethyl)-5a,9a-dihydro-5H-imidazo[5,1-a]isoindole
CID 130455684
6-[(1Z)-buta-1,3-dienyl]-7-ethenyl-5-[2-(1-fluoro-4-methylcyclohexyl)ethyl]-5H-pyrrolo[1,2-c]imidazole
CID 132218385
1-[(3E,5Z)-7-bromo-2-fluoroocta-3,5,7-trien-4-yl]-2-(2-butan-2-yl-6-methylcyclohexa-1,3-dien-1-yl)-4-prop-1-en-2-ylimidazole
CID 134286816
(2E,5Z)-N-ethyl-N-[3-[7-(1-fluoroethyl)-8-[(Z)-prop-1-enyl]-5,6-dihydroimidazo[1,5-a]pyridin-5-yl]butyl]hepta-2,5-dien-2-amine
CID 134291827

Frequently Asked Questions

What is the IUPAC name of 5-(2-cyclohexyl-2-fluoroethyl)-7-methyl-6-[(Z)-prop-1-enyl]-5H-pyrrolo[1,2-c]imidazole?
The IUPAC name of 5-(2-cyclohexyl-2-fluoroethyl)-7-methyl-6-[(Z)-prop-1-enyl]-5H-pyrrolo[1,2-c]imidazole (CID 142611000) is 5-(2-cyclohexyl-2-fluoroethyl)-7-methyl-6-[(Z)-prop-1-enyl]-5H-pyrrolo[1,2-c]imidazole.
What is the SMILES notation for 5-(2-cyclohexyl-2-fluoroethyl)-7-methyl-6-[(Z)-prop-1-enyl]-5H-pyrrolo[1,2-c]imidazole?
The canonical SMILES for 5-(2-cyclohexyl-2-fluoroethyl)-7-methyl-6-[(Z)-prop-1-enyl]-5H-pyrrolo[1,2-c]imidazole is C/C=C\C1=C(C)c2cncn2C1CC(F)C1CCCCC1.
What is the InChIKey of 5-(2-cyclohexyl-2-fluoroethyl)-7-methyl-6-[(Z)-prop-1-enyl]-5H-pyrrolo[1,2-c]imidazole?
The InChIKey is QWSSDQYFOSLEKY-CLTKARDFSA-N. The full InChI is InChI=1S/C18H25FN2/c1-3-7-15-13(2)18-11-20-12-21(18)17(15)10-16(19)14-8-5-4-6-9-14/h3,7,11-12,14,16-17H,4-6,8-10H2,1-2H3/b7-3-.
What are the key properties of 5-(2-cyclohexyl-2-fluoroethyl)-7-methyl-6-[(Z)-prop-1-enyl]-5H-pyrrolo[1,2-c]imidazole?
5-(2-cyclohexyl-2-fluoroethyl)-7-methyl-6-[(Z)-prop-1-enyl]-5H-pyrrolo[1,2-c]imidazole has a molecular weight of 288.41 g/mol, XLogP of 5.10, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-cyclohexyl-2-fluoroethyl)-7-methyl-6-[(Z)-prop-1-enyl]-5H-pyrrolo[1,2-c]imidazole is sourced from PubChem (CID 142611000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).