3-(hydroxymethyl)-11H-benzo[a]carbazol-2-ol

C17H13NO2 — CID 44579437

IUPAC3-(hydroxymethyl)-11H-benzo[a]carbazol-2-ol
SMILESOCc1cc2ccc3c4ccccc4[nH]c3c2cc1O
InChIInChI=1S/C17H13NO2/c19-9-11-7-10-5-6-13-12-3-1-2-4-15(12)18-17(13)14(10)8-16(11)20/h1-8,18-20H,9H2
InChIKeyHGNBRXZQFPKZEQ-UHFFFAOYSA-N
MW263.30 g/mol
LogP3.67
Rot. Bonds1

About 3-(hydroxymethyl)-11H-benzo[a]carbazol-2-ol

3-(hydroxymethyl)-11H-benzo[a]carbazol-2-ol (PubChem CID 44579437) has the molecular formula C17H13NO2 and a molecular weight of 263.30 g/mol. Its IUPAC name is 3-(hydroxymethyl)-11H-benzo[a]carbazol-2-ol.

Molecular Properties

Compound Name3-(hydroxymethyl)-11H-benzo[a]carbazol-2-ol
PubChem CID44579437
Molecular FormulaC17H13NO2
Molecular Weight263.30 g/mol
Exact Mass263.09
IUPAC Name3-(hydroxymethyl)-11H-benzo[a]carbazol-2-ol
SMILESOCc1cc2ccc3c4ccccc4[nH]c3c2cc1O
InChIInChI=1S/C17H13NO2/c19-9-11-7-10-5-6-13-12-3-1-2-4-15(12)18-17(13)14(10)8-16(11)20/h1-8,18-20H,9H2
InChIKeyHGNBRXZQFPKZEQ-UHFFFAOYSA-N
XLogP3.67
TPSA56.25 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 53.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-11H-benzo[a]carbazol-2-ol
CID 135394460
2-(2-hydroxy-11H-benzo[a]carbazol-3-yl)-N-(4-methoxyphenyl)acetamide
CID 139771930
ethane;2-hydroxy-11H-benzo[a]carbazole-3-carboxylic acid
CID 91394685
phenyl 2-hydroxy-11H-benzo[a]carbazole-3-carboxylate
CID 19933809
16-azahexacyclo[12.11.0.02,11.05,10.015,23.017,22]pentacosa-1(14),2(11),3,5,7,9,12,15(23),17,19,21,24-dodecaene
CID 86153881
9H-carbazol-1-ylmethanol
CID 10987211
23-azaoctacyclo[16.15.0.02,15.05,14.06,11.021,33.022,30.024,29]tritriaconta-1(18),2(15),3,5(14),6,8,10,12,16,19,21(33),22(30),24,26,28,31-hexadecaene
CID 141416725
2-hydroxy-N-(3-methylphenyl)-11H-benzo[a]carbazole-3-carboxamide
CID 14008608
2-hydroxy-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-11H-benzo[a]carbazole-3-carboxamide
CID 137495996
7-phenyl-7,20-diazapentacyclo[11.7.0.02,10.04,8.014,19]icosa-1(13),2(10),3,5,8,11,14,16,18-nonaene
CID 90223157
2-phenyl-9H-carbazol-1-ol
CID 118682381
2-hydroxy-N-[2-[[4-(N-phenylanilino)phenyl]methyl]phenyl]-11H-benzo[a]carbazole-3-carboxamide;methane
CID 159621347

Frequently Asked Questions

What is the IUPAC name of 3-(hydroxymethyl)-11H-benzo[a]carbazol-2-ol?
The IUPAC name of 3-(hydroxymethyl)-11H-benzo[a]carbazol-2-ol (CID 44579437) is 3-(hydroxymethyl)-11H-benzo[a]carbazol-2-ol.
What is the SMILES notation for 3-(hydroxymethyl)-11H-benzo[a]carbazol-2-ol?
The canonical SMILES for 3-(hydroxymethyl)-11H-benzo[a]carbazol-2-ol is OCc1cc2ccc3c4ccccc4[nH]c3c2cc1O.
What is the InChIKey of 3-(hydroxymethyl)-11H-benzo[a]carbazol-2-ol?
The InChIKey is HGNBRXZQFPKZEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13NO2/c19-9-11-7-10-5-6-13-12-3-1-2-4-15(12)18-17(13)14(10)8-16(11)20/h1-8,18-20H,9H2.
What are the key properties of 3-(hydroxymethyl)-11H-benzo[a]carbazol-2-ol?
3-(hydroxymethyl)-11H-benzo[a]carbazol-2-ol has a molecular weight of 263.30 g/mol, XLogP of 3.67, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(hydroxymethyl)-11H-benzo[a]carbazol-2-ol is sourced from PubChem (CID 44579437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).