10-methyl-6-phenyl-11H-pyrido[2,3-b][1,4]benzodiazepine

C19H15N3 — CID 135666732

IUPAC10-methyl-6-phenyl-11H-pyrido[2,3-b][1,4]benzodiazepine
SMILESCc1cccc2c1Nc1ncccc1N=C2c1ccccc1
InChIInChI=1S/C19H15N3/c1-13-7-5-10-15-17(13)22-19-16(11-6-12-20-19)21-18(15)14-8-3-2-4-9-14/h2-12H,1H3,(H,20,22)
InChIKeyRUFNCTVDYGJWKI-UHFFFAOYSA-N
MW285.35 g/mol
LogP4.62
Rot. Bonds1

About 10-methyl-6-phenyl-11H-pyrido[2,3-b][1,4]benzodiazepine

10-methyl-6-phenyl-11H-pyrido[2,3-b][1,4]benzodiazepine (PubChem CID 135666732) has the molecular formula C19H15N3 and a molecular weight of 285.35 g/mol. Its IUPAC name is 10-methyl-6-phenyl-11H-pyrido[2,3-b][1,4]benzodiazepine.

Molecular Properties

Compound Name10-methyl-6-phenyl-11H-pyrido[2,3-b][1,4]benzodiazepine
PubChem CID135666732
Molecular FormulaC19H15N3
Molecular Weight285.35 g/mol
Exact Mass285.13
IUPAC Name10-methyl-6-phenyl-11H-pyrido[2,3-b][1,4]benzodiazepine
SMILESCc1cccc2c1Nc1ncccc1N=C2c1ccccc1
InChIInChI=1S/C19H15N3/c1-13-7-5-10-15-17(13)22-19-16(11-6-12-20-19)21-18(15)14-8-3-2-4-9-14/h2-12H,1H3,(H,20,22)
InChIKeyRUFNCTVDYGJWKI-UHFFFAOYSA-N
XLogP4.62
TPSA37.28 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 10-methyl-6-phenyl-11H-pyrido[2,3-b][1,4]benzodiazepine?
The IUPAC name of 10-methyl-6-phenyl-11H-pyrido[2,3-b][1,4]benzodiazepine (CID 135666732) is 10-methyl-6-phenyl-11H-pyrido[2,3-b][1,4]benzodiazepine.
What is the SMILES notation for 10-methyl-6-phenyl-11H-pyrido[2,3-b][1,4]benzodiazepine?
The canonical SMILES for 10-methyl-6-phenyl-11H-pyrido[2,3-b][1,4]benzodiazepine is Cc1cccc2c1Nc1ncccc1N=C2c1ccccc1.
What is the InChIKey of 10-methyl-6-phenyl-11H-pyrido[2,3-b][1,4]benzodiazepine?
The InChIKey is RUFNCTVDYGJWKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3/c1-13-7-5-10-15-17(13)22-19-16(11-6-12-20-19)21-18(15)14-8-3-2-4-9-14/h2-12H,1H3,(H,20,22).
What are the key properties of 10-methyl-6-phenyl-11H-pyrido[2,3-b][1,4]benzodiazepine?
10-methyl-6-phenyl-11H-pyrido[2,3-b][1,4]benzodiazepine has a molecular weight of 285.35 g/mol, XLogP of 4.62, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-methyl-6-phenyl-11H-pyrido[2,3-b][1,4]benzodiazepine is sourced from PubChem (CID 135666732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).