1-(1H-indol-7-yl)-N-naphthalen-1-ylmethanimine

C19H14N2 — CID 23578067

IUPAC1-(1H-indol-7-yl)-N-naphthalen-1-ylmethanimine
SMILESC(=N/c1cccc2ccccc12)\c1cccc2cc[nH]c12
InChIInChI=1S/C19H14N2/c1-2-9-17-14(5-1)6-4-10-18(17)21-13-16-8-3-7-15-11-12-20-19(15)16/h1-13,20H/b21-13+
InChIKeyGJFCATBYAUPMKQ-FYJGNVAPSA-N
MW270.34 g/mol
LogP5.07
Rot. Bonds2

About 1-(1H-indol-7-yl)-N-naphthalen-1-ylmethanimine

1-(1H-indol-7-yl)-N-naphthalen-1-ylmethanimine (PubChem CID 23578067) has the molecular formula C19H14N2 and a molecular weight of 270.34 g/mol. Its IUPAC name is 1-(1H-indol-7-yl)-N-naphthalen-1-ylmethanimine.

Molecular Properties

Compound Name1-(1H-indol-7-yl)-N-naphthalen-1-ylmethanimine
PubChem CID23578067
Molecular FormulaC19H14N2
Molecular Weight270.34 g/mol
Exact Mass270.12
IUPAC Name1-(1H-indol-7-yl)-N-naphthalen-1-ylmethanimine
SMILESC(=N/c1cccc2ccccc12)\c1cccc2cc[nH]c12
InChIInChI=1S/C19H14N2/c1-2-9-17-14(5-1)6-4-10-18(17)21-13-16-8-3-7-15-11-12-20-19(15)16/h1-13,20H/b21-13+
InChIKeyGJFCATBYAUPMKQ-FYJGNVAPSA-N
XLogP5.07
TPSA28.15 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500270.34
LogP ≤ 55.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(1H-indol-7-yl)-N-naphthalen-1-ylmethanimine?
The IUPAC name of 1-(1H-indol-7-yl)-N-naphthalen-1-ylmethanimine (CID 23578067) is 1-(1H-indol-7-yl)-N-naphthalen-1-ylmethanimine.
What is the SMILES notation for 1-(1H-indol-7-yl)-N-naphthalen-1-ylmethanimine?
The canonical SMILES for 1-(1H-indol-7-yl)-N-naphthalen-1-ylmethanimine is C(=N/c1cccc2ccccc12)\c1cccc2cc[nH]c12.
What is the InChIKey of 1-(1H-indol-7-yl)-N-naphthalen-1-ylmethanimine?
The InChIKey is GJFCATBYAUPMKQ-FYJGNVAPSA-N. The full InChI is InChI=1S/C19H14N2/c1-2-9-17-14(5-1)6-4-10-18(17)21-13-16-8-3-7-15-11-12-20-19(15)16/h1-13,20H/b21-13+.
What are the key properties of 1-(1H-indol-7-yl)-N-naphthalen-1-ylmethanimine?
1-(1H-indol-7-yl)-N-naphthalen-1-ylmethanimine has a molecular weight of 270.34 g/mol, XLogP of 5.07, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-indol-7-yl)-N-naphthalen-1-ylmethanimine is sourced from PubChem (CID 23578067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).