10-pyridin-2-ylphenanthren-9-ol

C19H13NO — CID 135973428

IUPAC10-pyridin-2-ylphenanthren-9-ol
SMILESOc1c(-c2ccccn2)c2ccccc2c2ccccc12
InChIInChI=1S/C19H13NO/c21-19-16-10-4-2-8-14(16)13-7-1-3-9-15(13)18(19)17-11-5-6-12-20-17/h1-12,21H
InChIKeyKMPAJWWQSZCYSK-UHFFFAOYSA-N
MW271.32 g/mol
LogP4.76
Rot. Bonds1

About 10-pyridin-2-ylphenanthren-9-ol

10-pyridin-2-ylphenanthren-9-ol (PubChem CID 135973428) has the molecular formula C19H13NO and a molecular weight of 271.32 g/mol. Its IUPAC name is 10-pyridin-2-ylphenanthren-9-ol.

Molecular Properties

Compound Name10-pyridin-2-ylphenanthren-9-ol
PubChem CID135973428
Molecular FormulaC19H13NO
Molecular Weight271.32 g/mol
Exact Mass271.10
IUPAC Name10-pyridin-2-ylphenanthren-9-ol
SMILESOc1c(-c2ccccn2)c2ccccc2c2ccccc12
InChIInChI=1S/C19H13NO/c21-19-16-10-4-2-8-14(16)13-7-1-3-9-15(13)18(19)17-11-5-6-12-20-17/h1-12,21H
InChIKeyKMPAJWWQSZCYSK-UHFFFAOYSA-N
XLogP4.76
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 10-pyridin-2-ylphenanthren-9-ol?
The IUPAC name of 10-pyridin-2-ylphenanthren-9-ol (CID 135973428) is 10-pyridin-2-ylphenanthren-9-ol.
What is the SMILES notation for 10-pyridin-2-ylphenanthren-9-ol?
The canonical SMILES for 10-pyridin-2-ylphenanthren-9-ol is Oc1c(-c2ccccn2)c2ccccc2c2ccccc12.
What is the InChIKey of 10-pyridin-2-ylphenanthren-9-ol?
The InChIKey is KMPAJWWQSZCYSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13NO/c21-19-16-10-4-2-8-14(16)13-7-1-3-9-15(13)18(19)17-11-5-6-12-20-17/h1-12,21H.
What are the key properties of 10-pyridin-2-ylphenanthren-9-ol?
10-pyridin-2-ylphenanthren-9-ol has a molecular weight of 271.32 g/mol, XLogP of 4.76, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-pyridin-2-ylphenanthren-9-ol is sourced from PubChem (CID 135973428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).