1-butyl-3-methyl-2H-imidazole;molybdenum

C8H16MoN2 — CID 174105929

IUPAC1-butyl-3-methyl-2H-imidazole;molybdenum
SMILESCCCCN1C=CN(C)C1.[Mo]
InChIInChI=1S/C8H16N2.Mo/c1-3-4-5-10-7-6-9(2)8-10;/h6-7H,3-5,8H2,1-2H3;
InChIKeyFXKHNHAXNGHWID-UHFFFAOYSA-N
MW236.17 g/mol
LogP1.46
Rot. Bonds3

About 1-butyl-3-methyl-2H-imidazole;molybdenum

1-butyl-3-methyl-2H-imidazole;molybdenum (PubChem CID 174105929) has the molecular formula C8H16MoN2 and a molecular weight of 236.17 g/mol. Its IUPAC name is 1-butyl-3-methyl-2H-imidazole;molybdenum.

Molecular Properties

Compound Name1-butyl-3-methyl-2H-imidazole;molybdenum
PubChem CID174105929
Molecular FormulaC8H16MoN2
Molecular Weight236.17 g/mol
Exact Mass238.04
IUPAC Name1-butyl-3-methyl-2H-imidazole;molybdenum
SMILESCCCCN1C=CN(C)C1.[Mo]
InChIInChI=1S/C8H16N2.Mo/c1-3-4-5-10-7-6-9(2)8-10;/h6-7H,3-5,8H2,1-2H3;
InChIKeyFXKHNHAXNGHWID-UHFFFAOYSA-N
XLogP1.46
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.17
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-butyl-3-methyl-2H-imidazole
CID 10265934
CID 174105864
CID 174105864
tripotassium;1-butyl-3-methyl-2H-imidazole;hydride
CID 174886963
1-butyl-3-methyl-2H-imidazole;phosphane;hexahydrofluoride
CID 173166047
1-butyl-3-methyl-2H-imidazole;phosphorous acid
CID 174659773
aluminum;1-butyl-3-methyl-2H-imidazole;trichloride;hydrochloride
CID 172848443
zinc;1-butyl-3-methyl-2H-imidazole;ditetrafluoroborate
CID 175542670
1-hexyl-3-methyl-2H-imidazole
CID 18513318
1-methyl-3-nonadecyl-2H-imidazole
CID 69396698
1-butyl-3-methyl-2H-imidazole;hydron;hexafluorophosphate
CID 174451662
1-methyl-3-octadecyl-2H-imidazole;hydrochloride
CID 173017387
1-methyl-3-tridecyl-2H-imidazole;hydrochloride
CID 175556841

Frequently Asked Questions

What is the IUPAC name of 1-butyl-3-methyl-2H-imidazole;molybdenum?
The IUPAC name of 1-butyl-3-methyl-2H-imidazole;molybdenum (CID 174105929) is 1-butyl-3-methyl-2H-imidazole;molybdenum.
What is the SMILES notation for 1-butyl-3-methyl-2H-imidazole;molybdenum?
The canonical SMILES for 1-butyl-3-methyl-2H-imidazole;molybdenum is CCCCN1C=CN(C)C1.[Mo].
What is the InChIKey of 1-butyl-3-methyl-2H-imidazole;molybdenum?
The InChIKey is FXKHNHAXNGHWID-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2.Mo/c1-3-4-5-10-7-6-9(2)8-10;/h6-7H,3-5,8H2,1-2H3;.
What are the key properties of 1-butyl-3-methyl-2H-imidazole;molybdenum?
1-butyl-3-methyl-2H-imidazole;molybdenum has a molecular weight of 236.17 g/mol, XLogP of 1.46, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-3-methyl-2H-imidazole;molybdenum is sourced from PubChem (CID 174105929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).