9-octylcarbazol-1-ol

C20H25NO — CID 160567195

IUPAC9-octylcarbazol-1-ol
SMILESCCCCCCCCn1c2ccccc2c2cccc(O)c21
InChIInChI=1S/C20H25NO/c1-2-3-4-5-6-9-15-21-18-13-8-7-11-16(18)17-12-10-14-19(22)20(17)21/h7-8,10-14,22H,2-6,9,15H2,1H3
InChIKeyDFVPRJDBJQDRRL-UHFFFAOYSA-N
MW295.43 g/mol
LogP5.86
Rot. Bonds7

About 9-octylcarbazol-1-ol

9-octylcarbazol-1-ol (PubChem CID 160567195) has the molecular formula C20H25NO and a molecular weight of 295.43 g/mol. Its IUPAC name is 9-octylcarbazol-1-ol.

Molecular Properties

Compound Name9-octylcarbazol-1-ol
PubChem CID160567195
Molecular FormulaC20H25NO
Molecular Weight295.43 g/mol
Exact Mass295.19
IUPAC Name9-octylcarbazol-1-ol
SMILESCCCCCCCCn1c2ccccc2c2cccc(O)c21
InChIInChI=1S/C20H25NO/c1-2-3-4-5-6-9-15-21-18-13-8-7-11-16(18)17-12-10-14-19(22)20(17)21/h7-8,10-14,22H,2-6,9,15H2,1H3
InChIKeyDFVPRJDBJQDRRL-UHFFFAOYSA-N
XLogP5.86
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500295.43
LogP ≤ 55.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 9-octylcarbazol-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,11,19-trioctyl-3,11,19-triazapentacyclo[10.7.0.02,10.04,9.013,18]nonadeca-1(12),2(10),4,6,8,13,15,17-octaene
CID 132584282
1-bromo-9-heptadecylcarbazole
CID 174836685
9-hexadecylcarbazole
CID 4166588
9-docosylcarbazole
CID 10528568
2-(9-decylcarbazol-1-yl)benzene-1,4-diol
CID 68603527
benzene;9-octylcarbazole
CID 175067369
1-ethenyl-9-heptylcarbazole
CID 162355776
1,2-dibromo-9-hexylcarbazole
CID 141427471
15-decyl-3-thia-15-azahexacyclo[11.11.0.02,10.04,9.014,22.016,21]tetracosa-1(13),2(10),4,6,8,11,14(22),16,18,20,23-undecaene
CID 135242711
15-hexadecyl-3-thia-15-azahexacyclo[11.11.0.02,10.04,9.014,22.016,21]tetracosa-1(13),2(10),4,6,8,11,14(22),16,18,20,23-undecaene
CID 135242745
15-octyl-3-thia-15-azahexacyclo[11.11.0.02,10.04,9.014,22.016,21]tetracosa-1(13),2(10),4,6,8,11,14(22),16,18,20,23-undecaene
CID 135242710
(9-dodecylcarbazol-3-yl)methanol
CID 151995019

Frequently Asked Questions

What is the IUPAC name of 9-octylcarbazol-1-ol?
The IUPAC name of 9-octylcarbazol-1-ol (CID 160567195) is 9-octylcarbazol-1-ol.
What is the SMILES notation for 9-octylcarbazol-1-ol?
The canonical SMILES for 9-octylcarbazol-1-ol is CCCCCCCCn1c2ccccc2c2cccc(O)c21.
What is the InChIKey of 9-octylcarbazol-1-ol?
The InChIKey is DFVPRJDBJQDRRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO/c1-2-3-4-5-6-9-15-21-18-13-8-7-11-16(18)17-12-10-14-19(22)20(17)21/h7-8,10-14,22H,2-6,9,15H2,1H3.
What are the key properties of 9-octylcarbazol-1-ol?
9-octylcarbazol-1-ol has a molecular weight of 295.43 g/mol, XLogP of 5.86, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-octylcarbazol-1-ol is sourced from PubChem (CID 160567195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).