5-carbazol-9-ylpenta-2,4-diyn-1-ol

C17H11NO — CID 14150034

IUPAC5-carbazol-9-ylpenta-2,4-diyn-1-ol
SMILESOCC#CC#Cn1c2ccccc2c2ccccc21
InChIInChI=1S/C17H11NO/c19-13-7-1-6-12-18-16-10-4-2-8-14(16)15-9-3-5-11-17(15)18/h2-5,8-11,19H,13H2
InChIKeyAXQBOJZKGSBYJZ-UHFFFAOYSA-N
MW245.28 g/mol
LogP2.60
Rot. Bonds

About 5-carbazol-9-ylpenta-2,4-diyn-1-ol

5-carbazol-9-ylpenta-2,4-diyn-1-ol (PubChem CID 14150034) has the molecular formula C17H11NO and a molecular weight of 245.28 g/mol. Its IUPAC name is 5-carbazol-9-ylpenta-2,4-diyn-1-ol.

Molecular Properties

Compound Name5-carbazol-9-ylpenta-2,4-diyn-1-ol
PubChem CID14150034
Molecular FormulaC17H11NO
Molecular Weight245.28 g/mol
Exact Mass245.08
IUPAC Name5-carbazol-9-ylpenta-2,4-diyn-1-ol
SMILESOCC#CC#Cn1c2ccccc2c2ccccc21
InChIInChI=1S/C17H11NO/c19-13-7-1-6-12-18-16-10-4-2-8-14(16)15-9-3-5-11-17(15)18/h2-5,8-11,19H,13H2
InChIKeyAXQBOJZKGSBYJZ-UHFFFAOYSA-N
XLogP2.60
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

9-(5-carbazol-9-ylpenta-1,3-diynyl)carbazole
CID 101225046
9-(10-carbazol-9-yldeca-4,6-diynyl)carbazole;9-(6-carbazol-9-ylhexa-2,4-diynyl)carbazole
CID 22759893
1-(3-hydroxyprop-1-ynyl)naphthalen-2-ol
CID 169485554
carbazole-9-carbonyl fluoride
CID 45082000
9-(4-carbazol-9-ylnaphthalen-1-yl)carbazole
CID 154791880
ethane;9-hydroxycarbazole
CID 153391260
3-[3-bromo-9-(methoxymethyl)carbazol-2-yl]prop-2-yn-1-ol
CID 126970765
9-ethylsulfanylcarbazole
CID 151528824
carbazol-9-ylmethylphosphane
CID 90324544
(2R)-3-carbazol-9-yl-2-methylpropan-1-ol
CID 54249395
2-amino-3-carbazol-9-ylpropan-1-ol
CID 64810076
[9-[4-[4-[3-(hydroxymethyl)carbazol-9-yl]phenyl]phenyl]carbazol-3-yl]methanol
CID 58625620

Frequently Asked Questions

What is the IUPAC name of 5-carbazol-9-ylpenta-2,4-diyn-1-ol?
The IUPAC name of 5-carbazol-9-ylpenta-2,4-diyn-1-ol (CID 14150034) is 5-carbazol-9-ylpenta-2,4-diyn-1-ol.
What is the SMILES notation for 5-carbazol-9-ylpenta-2,4-diyn-1-ol?
The canonical SMILES for 5-carbazol-9-ylpenta-2,4-diyn-1-ol is OCC#CC#Cn1c2ccccc2c2ccccc21.
What is the InChIKey of 5-carbazol-9-ylpenta-2,4-diyn-1-ol?
The InChIKey is AXQBOJZKGSBYJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11NO/c19-13-7-1-6-12-18-16-10-4-2-8-14(16)15-9-3-5-11-17(15)18/h2-5,8-11,19H,13H2.
What are the key properties of 5-carbazol-9-ylpenta-2,4-diyn-1-ol?
5-carbazol-9-ylpenta-2,4-diyn-1-ol has a molecular weight of 245.28 g/mol, XLogP of 2.60, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-carbazol-9-ylpenta-2,4-diyn-1-ol is sourced from PubChem (CID 14150034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).