1-[(7-fluoronaphthalen-2-yl)methyl]imidazole

C14H11FN2 — CID 46887506

IUPAC1-[(7-fluoronaphthalen-2-yl)methyl]imidazole
SMILESFc1ccc2ccc(Cn3ccnc3)cc2c1
InChIInChI=1S/C14H11FN2/c15-14-4-3-12-2-1-11(7-13(12)8-14)9-17-6-5-16-10-17/h1-8,10H,9H2
InChIKeySFBANCVOUQRQEX-UHFFFAOYSA-N
MW226.25 g/mol
LogP3.22
Rot. Bonds2

About 1-[(7-fluoronaphthalen-2-yl)methyl]imidazole

1-[(7-fluoronaphthalen-2-yl)methyl]imidazole (PubChem CID 46887506) has the molecular formula C14H11FN2 and a molecular weight of 226.25 g/mol. Its IUPAC name is 1-[(7-fluoronaphthalen-2-yl)methyl]imidazole.

Molecular Properties

Compound Name1-[(7-fluoronaphthalen-2-yl)methyl]imidazole
PubChem CID46887506
Molecular FormulaC14H11FN2
Molecular Weight226.25 g/mol
Exact Mass226.09
IUPAC Name1-[(7-fluoronaphthalen-2-yl)methyl]imidazole
SMILESFc1ccc2ccc(Cn3ccnc3)cc2c1
InChIInChI=1S/C14H11FN2/c15-14-4-3-12-2-1-11(7-13(12)8-14)9-17-6-5-16-10-17/h1-8,10H,9H2
InChIKeySFBANCVOUQRQEX-UHFFFAOYSA-N
XLogP3.22
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.25
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Bifonazole
CID 2378
1-Benzylimidazole
CID 77918
Flutrimazole
CID 3401
1-(biphenyl-4-ylmethyl)-1H-imidazole
CID 12229396
1-(3,4-dihydronaphthalen-2-yl)-1H-imidazole
CID 3021558
3-[(1H-Imidazol-1-yl)methyl]benzonitrile
CID 24692916
Dechloroclotrimazole
CID 618231
1-methyl-5-(2-naphthyl)-1H-imidazole
CID 11550235
1-(1-Biphenyl-4-yl-2-phenyl-ethyl)-1H-imidazole
CID 13416469
1-(naphthalen-2-yl)-1H-imidazole
CID 23644748
1H-Imidazole, 1-(2-naphthalenylmethyl)-
CID 186582
4-[(4-Cyanophenyl)-imidazol-1-ylmethyl]benzonitrile
CID 133966

Frequently Asked Questions

What is the IUPAC name of 1-[(7-fluoronaphthalen-2-yl)methyl]imidazole?
The IUPAC name of 1-[(7-fluoronaphthalen-2-yl)methyl]imidazole (CID 46887506) is 1-[(7-fluoronaphthalen-2-yl)methyl]imidazole.
What is the SMILES notation for 1-[(7-fluoronaphthalen-2-yl)methyl]imidazole?
The canonical SMILES for 1-[(7-fluoronaphthalen-2-yl)methyl]imidazole is Fc1ccc2ccc(Cn3ccnc3)cc2c1.
What is the InChIKey of 1-[(7-fluoronaphthalen-2-yl)methyl]imidazole?
The InChIKey is SFBANCVOUQRQEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11FN2/c15-14-4-3-12-2-1-11(7-13(12)8-14)9-17-6-5-16-10-17/h1-8,10H,9H2.
What are the key properties of 1-[(7-fluoronaphthalen-2-yl)methyl]imidazole?
1-[(7-fluoronaphthalen-2-yl)methyl]imidazole has a molecular weight of 226.25 g/mol, XLogP of 3.22, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(7-fluoronaphthalen-2-yl)methyl]imidazole is sourced from PubChem (CID 46887506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).