1-[1-(2-hydroxy-3-naphthalen-2-ylpropyl)imidazol-2-yl]cyclobutan-1-ol

C20H22N2O2 — CID 167882740

IUPAC1-[1-(2-hydroxy-3-naphthalen-2-ylpropyl)imidazol-2-yl]cyclobutan-1-ol
SMILESOC(Cc1ccc2ccccc2c1)Cn1ccnc1C1(O)CCC1
InChIInChI=1S/C20H22N2O2/c23-18(13-15-6-7-16-4-1-2-5-17(16)12-15)14-22-11-10-21-19(22)20(24)8-3-9-20/h1-2,4-7,10-12,18,23-24H,3,8-9,13-14H2
InChIKeyVDURKJHFJLJUJD-UHFFFAOYSA-N
MW322.41 g/mol
LogP3.01
Rot. Bonds5

About 1-[1-(2-hydroxy-3-naphthalen-2-ylpropyl)imidazol-2-yl]cyclobutan-1-ol

1-[1-(2-hydroxy-3-naphthalen-2-ylpropyl)imidazol-2-yl]cyclobutan-1-ol (PubChem CID 167882740) has the molecular formula C20H22N2O2 and a molecular weight of 322.41 g/mol. Its IUPAC name is 1-[1-(2-hydroxy-3-naphthalen-2-ylpropyl)imidazol-2-yl]cyclobutan-1-ol.

Molecular Properties

Compound Name1-[1-(2-hydroxy-3-naphthalen-2-ylpropyl)imidazol-2-yl]cyclobutan-1-ol
PubChem CID167882740
Molecular FormulaC20H22N2O2
Molecular Weight322.41 g/mol
Exact Mass322.17
IUPAC Name1-[1-(2-hydroxy-3-naphthalen-2-ylpropyl)imidazol-2-yl]cyclobutan-1-ol
SMILESOC(Cc1ccc2ccccc2c1)Cn1ccnc1C1(O)CCC1
InChIInChI=1S/C20H22N2O2/c23-18(13-15-6-7-16-4-1-2-5-17(16)12-15)14-22-11-10-21-19(22)20(24)8-3-9-20/h1-2,4-7,10-12,18,23-24H,3,8-9,13-14H2
InChIKeyVDURKJHFJLJUJD-UHFFFAOYSA-N
XLogP3.01
TPSA58.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-ethylimidazol-2-yl)-3-naphthalen-2-ylpropan-2-ol
CID 105112307
1-[1-[(2-phenylphenyl)methyl]imidazol-2-yl]cyclobutan-1-ol
CID 166301570
2-chloro-1-(naphthalen-2-ylmethyl)imidazole
CID 141349461
1-methoxy-3-naphthalen-2-ylpropan-2-ol
CID 105112115
(7aS)-2-[(2S)-2-hydroxy-3-naphthalen-2-ylpropyl]-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazole-1,3-dione
CID 125140214
(7aR)-2-[(2R)-2-hydroxy-3-naphthalen-2-ylpropyl]-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazole-1,3-dione
CID 125140213
1-anthracen-2-ylbutan-2-ol
CID 141488114
1-(3-chlorophenyl)-3-naphthalen-2-ylpropan-2-ol
CID 105076762
1-(3-fluorophenyl)-3-naphthalen-2-ylpropan-2-ol
CID 105079027
(1S)-2-naphthalen-2-yl-1-phenylethanol
CID 101378142
2-[2-chloro-3-(1-methoxycyclobutyl)propyl]naphthalene
CID 103558104
1-naphthalen-2-yl-3-propan-2-yloxypropan-2-ol
CID 105114348

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-hydroxy-3-naphthalen-2-ylpropyl)imidazol-2-yl]cyclobutan-1-ol?
The IUPAC name of 1-[1-(2-hydroxy-3-naphthalen-2-ylpropyl)imidazol-2-yl]cyclobutan-1-ol (CID 167882740) is 1-[1-(2-hydroxy-3-naphthalen-2-ylpropyl)imidazol-2-yl]cyclobutan-1-ol.
What is the SMILES notation for 1-[1-(2-hydroxy-3-naphthalen-2-ylpropyl)imidazol-2-yl]cyclobutan-1-ol?
The canonical SMILES for 1-[1-(2-hydroxy-3-naphthalen-2-ylpropyl)imidazol-2-yl]cyclobutan-1-ol is OC(Cc1ccc2ccccc2c1)Cn1ccnc1C1(O)CCC1.
What is the InChIKey of 1-[1-(2-hydroxy-3-naphthalen-2-ylpropyl)imidazol-2-yl]cyclobutan-1-ol?
The InChIKey is VDURKJHFJLJUJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O2/c23-18(13-15-6-7-16-4-1-2-5-17(16)12-15)14-22-11-10-21-19(22)20(24)8-3-9-20/h1-2,4-7,10-12,18,23-24H,3,8-9,13-14H2.
What are the key properties of 1-[1-(2-hydroxy-3-naphthalen-2-ylpropyl)imidazol-2-yl]cyclobutan-1-ol?
1-[1-(2-hydroxy-3-naphthalen-2-ylpropyl)imidazol-2-yl]cyclobutan-1-ol has a molecular weight of 322.41 g/mol, XLogP of 3.01, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-hydroxy-3-naphthalen-2-ylpropyl)imidazol-2-yl]cyclobutan-1-ol is sourced from PubChem (CID 167882740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).