9-(4-methyl-2-pyridinyl)-2-[3-[methyl(pyridin-2-yl)phosphoryl]phenyl]carbazole

C30H24N3OP — CID 157460686

IUPAC9-(4-methyl-2-pyridinyl)-2-[3-[methyl(pyridin-2-yl)phosphoryl]phenyl]carbazole
SMILESCc1ccnc(-n2c3ccccc3c3ccc(-c4cccc(P(C)(=O)c5ccccn5)c4)cc32)c1
InChIInChI=1S/C30H24N3OP/c1-21-15-17-31-29(18-21)33-27-11-4-3-10-25(27)26-14-13-23(20-28(26)33)22-8-7-9-24(19-22)35(2,34)30-12-5-6-16-32-30/h3-20H,1-2H3
InChIKeyVULWQGFVUOHKPR-UHFFFAOYSA-N
MW473.52 g/mol
LogP6.49
Rot. Bonds4

About 9-(4-methyl-2-pyridinyl)-2-[3-[methyl(pyridin-2-yl)phosphoryl]phenyl]carbazole

9-(4-methyl-2-pyridinyl)-2-[3-[methyl(pyridin-2-yl)phosphoryl]phenyl]carbazole (PubChem CID 157460686) has the molecular formula C30H24N3OP and a molecular weight of 473.52 g/mol. Its IUPAC name is 9-(4-methyl-2-pyridinyl)-2-[3-[methyl(pyridin-2-yl)phosphoryl]phenyl]carbazole.

Molecular Properties

Compound Name9-(4-methyl-2-pyridinyl)-2-[3-[methyl(pyridin-2-yl)phosphoryl]phenyl]carbazole
PubChem CID157460686
Molecular FormulaC30H24N3OP
Molecular Weight473.52 g/mol
Exact Mass473.17
IUPAC Name9-(4-methyl-2-pyridinyl)-2-[3-[methyl(pyridin-2-yl)phosphoryl]phenyl]carbazole
SMILESCc1ccnc(-n2c3ccccc3c3ccc(-c4cccc(P(C)(=O)c5ccccn5)c4)cc32)c1
InChIInChI=1S/C30H24N3OP/c1-21-15-17-31-29(18-21)33-27-11-4-3-10-25(27)26-14-13-23(20-28(26)33)22-8-7-9-24(19-22)35(2,34)30-12-5-6-16-32-30/h3-20H,1-2H3
InChIKeyVULWQGFVUOHKPR-UHFFFAOYSA-N
XLogP6.49
TPSA47.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500473.52
LogP ≤ 56.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

dimethyl-(3-methyl-2-pyridinyl)-[3-[9-(4-methyl-2-pyridinyl)carbazol-2-yl]phenyl]silane
CID 157115995
2-N,4-N,4-N-trimethyl-2-N-[3-[9-(4-methyl-2-pyridinyl)carbazol-2-yl]phenyl]pyridine-2,4-diamine
CID 158471728
3,7-diphenyl-5-pyridin-2-ylindolo[2,3-b]carbazole
CID 149342051
2-phenyl-9-(9-pyridin-2-ylcarbazol-2-yl)carbazole
CID 71478701
2,7-dimethyl-9-pyridin-2-ylcarbazole
CID 59557260
[3-[9-(4-tert-butyl-2-pyridinyl)carbazol-2-yl]phenyl]-methyl-(4-methyl-2-pyridinyl)phosphane
CID 157440294
9-[3-[phenyl(pyridin-2-yl)phosphoryl]phenyl]-3-[9-[3-[phenyl(pyridin-2-yl)phosphoryl]phenyl]carbazol-3-yl]carbazole
CID 164937824
9-(6-methyl-2-pyridinyl)-2-[3-[(4-methyl-2-pyridinyl)oxy]phenyl]carbazole
CID 153421943
9-(4-methyl-2-pyridinyl)-N-[9-(4-methyl-2-pyridinyl)carbazol-2-yl]-N-phenylcarbazol-2-amine
CID 140743280
methyl-[3-[9-(5-methyl-2-pyridinyl)carbazol-2-yl]phenyl]-pyridin-2-ylborane
CID 158652282
2-[3-[(4-methoxy-2-pyridinyl)oxy]phenyl]-9-pyridin-2-ylcarbazole
CID 153421155
9-[4-(2-carbazol-9-yl-4-pyridinyl)-2-pyridinyl]-3-ethenyl-6-methylcarbazole
CID 121245502

Frequently Asked Questions

What is the IUPAC name of 9-(4-methyl-2-pyridinyl)-2-[3-[methyl(pyridin-2-yl)phosphoryl]phenyl]carbazole?
The IUPAC name of 9-(4-methyl-2-pyridinyl)-2-[3-[methyl(pyridin-2-yl)phosphoryl]phenyl]carbazole (CID 157460686) is 9-(4-methyl-2-pyridinyl)-2-[3-[methyl(pyridin-2-yl)phosphoryl]phenyl]carbazole.
What is the SMILES notation for 9-(4-methyl-2-pyridinyl)-2-[3-[methyl(pyridin-2-yl)phosphoryl]phenyl]carbazole?
The canonical SMILES for 9-(4-methyl-2-pyridinyl)-2-[3-[methyl(pyridin-2-yl)phosphoryl]phenyl]carbazole is Cc1ccnc(-n2c3ccccc3c3ccc(-c4cccc(P(C)(=O)c5ccccn5)c4)cc32)c1.
What is the InChIKey of 9-(4-methyl-2-pyridinyl)-2-[3-[methyl(pyridin-2-yl)phosphoryl]phenyl]carbazole?
The InChIKey is VULWQGFVUOHKPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H24N3OP/c1-21-15-17-31-29(18-21)33-27-11-4-3-10-25(27)26-14-13-23(20-28(26)33)22-8-7-9-24(19-22)35(2,34)30-12-5-6-16-32-30/h3-20H,1-2H3.
What are the key properties of 9-(4-methyl-2-pyridinyl)-2-[3-[methyl(pyridin-2-yl)phosphoryl]phenyl]carbazole?
9-(4-methyl-2-pyridinyl)-2-[3-[methyl(pyridin-2-yl)phosphoryl]phenyl]carbazole has a molecular weight of 473.52 g/mol, XLogP of 6.49, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-methyl-2-pyridinyl)-2-[3-[methyl(pyridin-2-yl)phosphoryl]phenyl]carbazole is sourced from PubChem (CID 157460686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).