3,4-dihydro-2H-naphthalen-1-imine

C10H11N — CID 11019004

IUPAC3,4-dihydro-2H-naphthalen-1-imine
SMILES[H]/N=C1\CCCc2ccccc21
InChIInChI=1S/C10H11N/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6,11H,3,5,7H2/b11-10+
InChIKeyBBCSZRYYOXKAQD-ZHACJKMWSA-N
MW145.21 g/mol
LogP2.39
Rot. Bonds

About 3,4-dihydro-2H-naphthalen-1-imine

3,4-dihydro-2H-naphthalen-1-imine (PubChem CID 11019004) has the molecular formula C10H11N and a molecular weight of 145.21 g/mol. Its IUPAC name is 3,4-dihydro-2H-naphthalen-1-imine.

Molecular Properties

Compound Name3,4-dihydro-2H-naphthalen-1-imine
PubChem CID11019004
Molecular FormulaC10H11N
Molecular Weight145.21 g/mol
Exact Mass145.09
IUPAC Name3,4-dihydro-2H-naphthalen-1-imine
SMILES[H]/N=C1\CCCc2ccccc21
InChIInChI=1S/C10H11N/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6,11H,3,5,7H2/b11-10+
InChIKeyBBCSZRYYOXKAQD-ZHACJKMWSA-N
XLogP2.39
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.21
LogP ≤ 52.39
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 3,4-dihydro-2H-naphthalen-1-imine?
The IUPAC name of 3,4-dihydro-2H-naphthalen-1-imine (CID 11019004) is 3,4-dihydro-2H-naphthalen-1-imine.
What is the SMILES notation for 3,4-dihydro-2H-naphthalen-1-imine?
The canonical SMILES for 3,4-dihydro-2H-naphthalen-1-imine is [H]/N=C1\CCCc2ccccc21.
What is the InChIKey of 3,4-dihydro-2H-naphthalen-1-imine?
The InChIKey is BBCSZRYYOXKAQD-ZHACJKMWSA-N. The full InChI is InChI=1S/C10H11N/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6,11H,3,5,7H2/b11-10+.
What are the key properties of 3,4-dihydro-2H-naphthalen-1-imine?
3,4-dihydro-2H-naphthalen-1-imine has a molecular weight of 145.21 g/mol, XLogP of 2.39, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-naphthalen-1-imine is sourced from PubChem (CID 11019004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).