3-[(E)-3-aminoprop-1-enyl]naphthalen-2-ol

C13H13NO — CID 117288743

IUPAC3-[(E)-3-aminoprop-1-enyl]naphthalen-2-ol
SMILESNC/C=C/c1cc2ccccc2cc1O
InChIInChI=1S/C13H13NO/c14-7-3-6-12-8-10-4-1-2-5-11(10)9-13(12)15/h1-6,8-9,15H,7,14H2/b6-3+
InChIKeyHZAZEIITCQVNDW-ZZXKWVIFSA-N
MW199.25 g/mol
LogP2.52
Rot. Bonds2

About 3-[(E)-3-aminoprop-1-enyl]naphthalen-2-ol

3-[(E)-3-aminoprop-1-enyl]naphthalen-2-ol (PubChem CID 117288743) has the molecular formula C13H13NO and a molecular weight of 199.25 g/mol. Its IUPAC name is 3-[(E)-3-aminoprop-1-enyl]naphthalen-2-ol.

Molecular Properties

Compound Name3-[(E)-3-aminoprop-1-enyl]naphthalen-2-ol
PubChem CID117288743
Molecular FormulaC13H13NO
Molecular Weight199.25 g/mol
Exact Mass199.10
IUPAC Name3-[(E)-3-aminoprop-1-enyl]naphthalen-2-ol
SMILESNC/C=C/c1cc2ccccc2cc1O
InChIInChI=1S/C13H13NO/c14-7-3-6-12-8-10-4-1-2-5-11(10)9-13(12)15/h1-6,8-9,15H,7,14H2/b6-3+
InChIKeyHZAZEIITCQVNDW-ZZXKWVIFSA-N
XLogP2.52
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-[(E)-3-aminoprop-1-enyl]naphthalen-2-ol?
The IUPAC name of 3-[(E)-3-aminoprop-1-enyl]naphthalen-2-ol (CID 117288743) is 3-[(E)-3-aminoprop-1-enyl]naphthalen-2-ol.
What is the SMILES notation for 3-[(E)-3-aminoprop-1-enyl]naphthalen-2-ol?
The canonical SMILES for 3-[(E)-3-aminoprop-1-enyl]naphthalen-2-ol is NC/C=C/c1cc2ccccc2cc1O.
What is the InChIKey of 3-[(E)-3-aminoprop-1-enyl]naphthalen-2-ol?
The InChIKey is HZAZEIITCQVNDW-ZZXKWVIFSA-N. The full InChI is InChI=1S/C13H13NO/c14-7-3-6-12-8-10-4-1-2-5-11(10)9-13(12)15/h1-6,8-9,15H,7,14H2/b6-3+.
What are the key properties of 3-[(E)-3-aminoprop-1-enyl]naphthalen-2-ol?
3-[(E)-3-aminoprop-1-enyl]naphthalen-2-ol has a molecular weight of 199.25 g/mol, XLogP of 2.52, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(E)-3-aminoprop-1-enyl]naphthalen-2-ol is sourced from PubChem (CID 117288743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).