1-[(5R)-5-methoxydecyl]imidazole

C14H26N2O — CID 118890185

IUPAC1-[(5R)-5-methoxydecyl]imidazole
SMILESCCCCC[C@H](CCCCn1ccnc1)OC
InChIInChI=1S/C14H26N2O/c1-3-4-5-8-14(17-2)9-6-7-11-16-12-10-15-13-16/h10,12-14H,3-9,11H2,1-2H3/t14-/m1/s1
InChIKeyRIFOAQFMSANAAQ-CQSZACIVSA-N
MW238.38 g/mol
LogP3.65
Rot. Bonds10

About 1-[(5R)-5-methoxydecyl]imidazole

1-[(5R)-5-methoxydecyl]imidazole (PubChem CID 118890185) has the molecular formula C14H26N2O and a molecular weight of 238.38 g/mol. Its IUPAC name is 1-[(5R)-5-methoxydecyl]imidazole.

Molecular Properties

Compound Name1-[(5R)-5-methoxydecyl]imidazole
PubChem CID118890185
Molecular FormulaC14H26N2O
Molecular Weight238.38 g/mol
Exact Mass238.20
IUPAC Name1-[(5R)-5-methoxydecyl]imidazole
SMILESCCCCC[C@H](CCCCn1ccnc1)OC
InChIInChI=1S/C14H26N2O/c1-3-4-5-8-14(17-2)9-6-7-11-16-12-10-15-13-16/h10,12-14H,3-9,11H2,1-2H3/t14-/m1/s1
InChIKeyRIFOAQFMSANAAQ-CQSZACIVSA-N
XLogP3.65
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.38
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(5S)-1-imidazol-1-yldecan-5-ol
CID 118890121
1-nonylimidazole;hydrobromide
CID 175434544
2-(4-imidazol-1-ylbutyl)heptan-1-ol
CID 174409520
(5R)-1-imidazol-1-ylnonan-5-ol
CID 118889923
methyl dihydrogen phosphite;1-pentylimidazole
CID 174884184
1-decan-5-yloxy-5-imidazol-1-ylpentan-2-one
CID 170645890
(5R)-10-imidazol-1-yldecan-5-ol
CID 118889895
bis(1-butylimidazole);heptane;dihydrobromide
CID 175107148
carbonic acid;1-dodecylimidazole
CID 175596781
N-(8-heptadecan-9-yloxyoctyl)-N-(3-imidazol-1-ylpropyl)nonan-1-amine
CID 146179962
sodium;1-butylimidazole;bromide
CID 175480877
acetic acid;1-decylimidazole
CID 175546754

Frequently Asked Questions

What is the IUPAC name of 1-[(5R)-5-methoxydecyl]imidazole?
The IUPAC name of 1-[(5R)-5-methoxydecyl]imidazole (CID 118890185) is 1-[(5R)-5-methoxydecyl]imidazole.
What is the SMILES notation for 1-[(5R)-5-methoxydecyl]imidazole?
The canonical SMILES for 1-[(5R)-5-methoxydecyl]imidazole is CCCCC[C@H](CCCCn1ccnc1)OC.
What is the InChIKey of 1-[(5R)-5-methoxydecyl]imidazole?
The InChIKey is RIFOAQFMSANAAQ-CQSZACIVSA-N. The full InChI is InChI=1S/C14H26N2O/c1-3-4-5-8-14(17-2)9-6-7-11-16-12-10-15-13-16/h10,12-14H,3-9,11H2,1-2H3/t14-/m1/s1.
What are the key properties of 1-[(5R)-5-methoxydecyl]imidazole?
1-[(5R)-5-methoxydecyl]imidazole has a molecular weight of 238.38 g/mol, XLogP of 3.65, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5R)-5-methoxydecyl]imidazole is sourced from PubChem (CID 118890185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).