1,2-dihydropyrido[2,3-c][1]benzazocine

C14H12N2 — CID 69292210

IUPAC1,2-dihydropyrido[2,3-c][1]benzazocine
SMILESC1=CC2=CC=c3cccc/c3=N/C=C2NC1
InChIInChI=1S/C14H12N2/c1-2-6-13-11(4-1)7-8-12-5-3-9-15-14(12)10-16-13/h1-8,10,15H,9H2/b8-7?,11-7?,12-8?,14-10?,16-10?,16-13-
InChIKeyOYVXIUSNIYFERG-COVOMLPGSA-N
MW208.26 g/mol
LogP1.03
Rot. Bonds

About 1,2-dihydropyrido[2,3-c][1]benzazocine

1,2-dihydropyrido[2,3-c][1]benzazocine (PubChem CID 69292210) has the molecular formula C14H12N2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 1,2-dihydropyrido[2,3-c][1]benzazocine.

Molecular Properties

Compound Name1,2-dihydropyrido[2,3-c][1]benzazocine
PubChem CID69292210
Molecular FormulaC14H12N2
Molecular Weight208.26 g/mol
Exact Mass208.10
IUPAC Name1,2-dihydropyrido[2,3-c][1]benzazocine
SMILESC1=CC2=CC=c3cccc/c3=N/C=C2NC1
InChIInChI=1S/C14H12N2/c1-2-6-13-11(4-1)7-8-12-5-3-9-15-14(12)10-16-13/h1-8,10,15H,9H2/b8-7?,11-7?,12-8?,14-10?,16-10?,16-13-
InChIKeyOYVXIUSNIYFERG-COVOMLPGSA-N
XLogP1.03
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 137465231
(2E)-2-ethenyl-4-fluoro-N-[(4E)-4-methyl-5-[[(E)-3-methylpent-3-en-2-ylidene]amino]penta-1,4-dien-2-yl]penta-2,4-dien-1-amine
CID 137465238
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CID 141446873
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CID 91293056
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CID 135039127
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CID 177255998
(2E,4E)-N-[[3-[(Z)-but-1-enyl]imino-4-iminocyclohexa-1,5-dien-1-yl]methyl]-5-fluoro-4-methylhepta-2,4,6-trien-3-amine
CID 176561633

Frequently Asked Questions

What is the IUPAC name of 1,2-dihydropyrido[2,3-c][1]benzazocine?
The IUPAC name of 1,2-dihydropyrido[2,3-c][1]benzazocine (CID 69292210) is 1,2-dihydropyrido[2,3-c][1]benzazocine.
What is the SMILES notation for 1,2-dihydropyrido[2,3-c][1]benzazocine?
The canonical SMILES for 1,2-dihydropyrido[2,3-c][1]benzazocine is C1=CC2=CC=c3cccc/c3=N/C=C2NC1.
What is the InChIKey of 1,2-dihydropyrido[2,3-c][1]benzazocine?
The InChIKey is OYVXIUSNIYFERG-COVOMLPGSA-N. The full InChI is InChI=1S/C14H12N2/c1-2-6-13-11(4-1)7-8-12-5-3-9-15-14(12)10-16-13/h1-8,10,15H,9H2/b8-7?,11-7?,12-8?,14-10?,16-10?,16-13-.
What are the key properties of 1,2-dihydropyrido[2,3-c][1]benzazocine?
1,2-dihydropyrido[2,3-c][1]benzazocine has a molecular weight of 208.26 g/mol, XLogP of 1.03, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dihydropyrido[2,3-c][1]benzazocine is sourced from PubChem (CID 69292210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).