fluoromethane;1-hexyl-3-methyl-2H-imidazole

C11H23FN2 — CID 174715359

IUPACfluoromethane;1-hexyl-3-methyl-2H-imidazole
SMILESCCCCCCN1C=CN(C)C1.CF
InChIInChI=1S/C10H20N2.CH3F/c1-3-4-5-6-7-12-9-8-11(2)10-12;1-2/h8-9H,3-7,10H2,1-2H3;1H3
InChIKeyRCFWPHFQQUOEDO-UHFFFAOYSA-N
MW202.32 g/mol
LogP2.83
Rot. Bonds5

About fluoromethane;1-hexyl-3-methyl-2H-imidazole

fluoromethane;1-hexyl-3-methyl-2H-imidazole (PubChem CID 174715359) has the molecular formula C11H23FN2 and a molecular weight of 202.32 g/mol. Its IUPAC name is fluoromethane;1-hexyl-3-methyl-2H-imidazole.

Molecular Properties

Compound Namefluoromethane;1-hexyl-3-methyl-2H-imidazole
PubChem CID174715359
Molecular FormulaC11H23FN2
Molecular Weight202.32 g/mol
Exact Mass202.18
IUPAC Namefluoromethane;1-hexyl-3-methyl-2H-imidazole
SMILESCCCCCCN1C=CN(C)C1.CF
InChIInChI=1S/C10H20N2.CH3F/c1-3-4-5-6-7-12-9-8-11(2)10-12;1-2/h8-9H,3-7,10H2,1-2H3;1H3
InChIKeyRCFWPHFQQUOEDO-UHFFFAOYSA-N
XLogP2.83
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.32
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-hexyl-3-methyl-2H-imidazole
CID 18513318
1-methyl-3-nonadecyl-2H-imidazole
CID 69396698
1-methyl-3-octadecyl-2H-imidazole;hydrochloride
CID 173017387
1-methyl-3-tridecyl-2H-imidazole;hydrochloride
CID 175556841
1-decyl-3-methyl-2H-imidazole;hydrofluoride
CID 174870192
1-methyl-3-octyl-2H-imidazole;hydrate
CID 172807129
1-hexadecyl-3-methyl-2H-imidazole tetrafluoroborate
CID 159038407
dichlorozinc;1-hexyl-3-methyl-2H-imidazole
CID 174760028
1-methyl-3-undecyl-2H-imidazole;tetrachlorotitanium
CID 162018722
1-butyl-3-methyl-2H-imidazole
CID 10265934
1-hexyl-3-methyl-2H-imidazole acetate
CID 162278554
1-butyl-3-methyl-2H-imidazole;molybdenum
CID 174105929

Frequently Asked Questions

What is the IUPAC name of fluoromethane;1-hexyl-3-methyl-2H-imidazole?
The IUPAC name of fluoromethane;1-hexyl-3-methyl-2H-imidazole (CID 174715359) is fluoromethane;1-hexyl-3-methyl-2H-imidazole.
What is the SMILES notation for fluoromethane;1-hexyl-3-methyl-2H-imidazole?
The canonical SMILES for fluoromethane;1-hexyl-3-methyl-2H-imidazole is CCCCCCN1C=CN(C)C1.CF.
What is the InChIKey of fluoromethane;1-hexyl-3-methyl-2H-imidazole?
The InChIKey is RCFWPHFQQUOEDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2.CH3F/c1-3-4-5-6-7-12-9-8-11(2)10-12;1-2/h8-9H,3-7,10H2,1-2H3;1H3.
What are the key properties of fluoromethane;1-hexyl-3-methyl-2H-imidazole?
fluoromethane;1-hexyl-3-methyl-2H-imidazole has a molecular weight of 202.32 g/mol, XLogP of 2.83, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for fluoromethane;1-hexyl-3-methyl-2H-imidazole is sourced from PubChem (CID 174715359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).