1-(cyclopropyliminomethyl)naphthalen-2-ol

C14H13NO — CID 4848190

IUPAC1-(cyclopropyliminomethyl)naphthalen-2-ol
SMILESOc1ccc2ccccc2c1/C=N/C1CC1
InChIInChI=1S/C14H13NO/c16-14-8-5-10-3-1-2-4-12(10)13(14)9-15-11-6-7-11/h1-5,8-9,11,16H,6-7H2/b15-9+
InChIKeyIEEWDTKSKCDDGI-OQLLNIDSSA-N
MW211.26 g/mol
LogP3.13
Rot. Bonds2

About 1-(cyclopropyliminomethyl)naphthalen-2-ol

1-(cyclopropyliminomethyl)naphthalen-2-ol (PubChem CID 4848190) has the molecular formula C14H13NO and a molecular weight of 211.26 g/mol. Its IUPAC name is 1-(cyclopropyliminomethyl)naphthalen-2-ol.

Molecular Properties

Compound Name1-(cyclopropyliminomethyl)naphthalen-2-ol
PubChem CID4848190
Molecular FormulaC14H13NO
Molecular Weight211.26 g/mol
Exact Mass211.10
IUPAC Name1-(cyclopropyliminomethyl)naphthalen-2-ol
SMILESOc1ccc2ccccc2c1/C=N/C1CC1
InChIInChI=1S/C14H13NO/c16-14-8-5-10-3-1-2-4-12(10)13(14)9-15-11-6-7-11/h1-5,8-9,11,16H,6-7H2/b15-9+
InChIKeyIEEWDTKSKCDDGI-OQLLNIDSSA-N
XLogP3.13
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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-(cyclopropyliminomethyl)naphthalen-2-ol?
The IUPAC name of 1-(cyclopropyliminomethyl)naphthalen-2-ol (CID 4848190) is 1-(cyclopropyliminomethyl)naphthalen-2-ol.
What is the SMILES notation for 1-(cyclopropyliminomethyl)naphthalen-2-ol?
The canonical SMILES for 1-(cyclopropyliminomethyl)naphthalen-2-ol is Oc1ccc2ccccc2c1/C=N/C1CC1.
What is the InChIKey of 1-(cyclopropyliminomethyl)naphthalen-2-ol?
The InChIKey is IEEWDTKSKCDDGI-OQLLNIDSSA-N. The full InChI is InChI=1S/C14H13NO/c16-14-8-5-10-3-1-2-4-12(10)13(14)9-15-11-6-7-11/h1-5,8-9,11,16H,6-7H2/b15-9+.
What are the key properties of 1-(cyclopropyliminomethyl)naphthalen-2-ol?
1-(cyclopropyliminomethyl)naphthalen-2-ol has a molecular weight of 211.26 g/mol, XLogP of 3.13, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropyliminomethyl)naphthalen-2-ol is sourced from PubChem (CID 4848190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).