1-carbazol-9-yl-3-imidazol-1-ylpropan-2-ol;ethane

C20H23N3O — CID 144822333

IUPAC1-carbazol-9-yl-3-imidazol-1-ylpropan-2-ol;ethane
SMILESCC.OC(Cn1ccnc1)Cn1c2ccccc2c2ccccc21
InChIInChI=1S/C18H17N3O.C2H6/c22-14(11-20-10-9-19-13-20)12-21-17-7-3-1-5-15(17)16-6-2-4-8-18(16)21;1-2/h1-10,13-14,22H,11-12H2;1-2H3
InChIKeyWXIVEBDPDXYHBF-UHFFFAOYSA-N
MW321.42 g/mol
LogP4.08
Rot. Bonds4

About 1-carbazol-9-yl-3-imidazol-1-ylpropan-2-ol;ethane

1-carbazol-9-yl-3-imidazol-1-ylpropan-2-ol;ethane (PubChem CID 144822333) has the molecular formula C20H23N3O and a molecular weight of 321.42 g/mol. Its IUPAC name is 1-carbazol-9-yl-3-imidazol-1-ylpropan-2-ol;ethane.

Molecular Properties

Compound Name1-carbazol-9-yl-3-imidazol-1-ylpropan-2-ol;ethane
PubChem CID144822333
Molecular FormulaC20H23N3O
Molecular Weight321.42 g/mol
Exact Mass321.18
IUPAC Name1-carbazol-9-yl-3-imidazol-1-ylpropan-2-ol;ethane
SMILESCC.OC(Cn1ccnc1)Cn1c2ccccc2c2ccccc21
InChIInChI=1S/C18H17N3O.C2H6/c22-14(11-20-10-9-19-13-20)12-21-17-7-3-1-5-15(17)16-6-2-4-8-18(16)21;1-2/h1-10,13-14,22H,11-12H2;1-2H3
InChIKeyWXIVEBDPDXYHBF-UHFFFAOYSA-N
XLogP4.08
TPSA42.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.42
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-1-carbazol-9-yl-3-(dipropylamino)propan-2-ol
CID 726400
[(2R)-3-carbazol-9-yl-2-hydroxypropyl]-trimethylazanium
CID 910212
[(2S)-3-carbazol-9-yl-2-hydroxypropyl]-methylazanium
CID 2138697
[(2R)-3-carbazol-9-yl-2-hydroxypropyl]-dimethylazanium
CID 6577414
2-(3-carbazol-9-yl-2-hydroxypropyl)-1-methyl-1,2,4-triazol-3-one
CID 166319763
1-imidazol-1-yl-N-[(1-methylindazol-3-yl)methyl]propan-2-amine
CID 63000923
(2R)-1-carbazol-9-yl-3-[2-[(1R)-1-hydroxyethyl]benzimidazol-1-yl]propan-2-ol
CID 7000828
(2R)-1-carbazol-9-yl-3-(2,4,4-trimethylpentan-2-ylamino)propan-2-ol
CID 7411148
N-(3-carbazol-9-yl-2-hydroxypropyl)-N-ethylmethanesulfinamide
CID 135295654
(2R)-1-(1-chloronaphthalen-2-yl)oxy-3-imidazol-1-ylpropan-2-ol
CID 714826
N-(1-imidazol-1-ylbutan-2-yl)-1-methylindole-3-carboxamide
CID 56744427
1-carbazol-9-yl-3-(4,5-diphenylimidazol-1-yl)propan-2-ol
CID 2836174

Frequently Asked Questions

What is the IUPAC name of 1-carbazol-9-yl-3-imidazol-1-ylpropan-2-ol;ethane?
The IUPAC name of 1-carbazol-9-yl-3-imidazol-1-ylpropan-2-ol;ethane (CID 144822333) is 1-carbazol-9-yl-3-imidazol-1-ylpropan-2-ol;ethane.
What is the SMILES notation for 1-carbazol-9-yl-3-imidazol-1-ylpropan-2-ol;ethane?
The canonical SMILES for 1-carbazol-9-yl-3-imidazol-1-ylpropan-2-ol;ethane is CC.OC(Cn1ccnc1)Cn1c2ccccc2c2ccccc21.
What is the InChIKey of 1-carbazol-9-yl-3-imidazol-1-ylpropan-2-ol;ethane?
The InChIKey is WXIVEBDPDXYHBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O.C2H6/c22-14(11-20-10-9-19-13-20)12-21-17-7-3-1-5-15(17)16-6-2-4-8-18(16)21;1-2/h1-10,13-14,22H,11-12H2;1-2H3.
What are the key properties of 1-carbazol-9-yl-3-imidazol-1-ylpropan-2-ol;ethane?
1-carbazol-9-yl-3-imidazol-1-ylpropan-2-ol;ethane has a molecular weight of 321.42 g/mol, XLogP of 4.08, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-carbazol-9-yl-3-imidazol-1-ylpropan-2-ol;ethane is sourced from PubChem (CID 144822333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).