3-(3-aminopropyl)naphthalen-2-ol

C13H15NO — CID 117290164

IUPAC3-(3-aminopropyl)naphthalen-2-ol
SMILESNCCCc1cc2ccccc2cc1O
InChIInChI=1S/C13H15NO/c14-7-3-6-12-8-10-4-1-2-5-11(10)9-13(12)15/h1-2,4-5,8-9,15H,3,6-7,14H2
InChIKeyLWKIQXCQAPMOIE-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.44
Rot. Bonds3

About 3-(3-aminopropyl)naphthalen-2-ol

3-(3-aminopropyl)naphthalen-2-ol (PubChem CID 117290164) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is 3-(3-aminopropyl)naphthalen-2-ol.

Molecular Properties

Compound Name3-(3-aminopropyl)naphthalen-2-ol
PubChem CID117290164
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC Name3-(3-aminopropyl)naphthalen-2-ol
SMILESNCCCc1cc2ccccc2cc1O
InChIInChI=1S/C13H15NO/c14-7-3-6-12-8-10-4-1-2-5-11(10)9-13(12)15/h1-2,4-5,8-9,15H,3,6-7,14H2
InChIKeyLWKIQXCQAPMOIE-UHFFFAOYSA-N
XLogP2.44
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(3-aminopropyl)naphthalen-2-ol?
The IUPAC name of 3-(3-aminopropyl)naphthalen-2-ol (CID 117290164) is 3-(3-aminopropyl)naphthalen-2-ol.
What is the SMILES notation for 3-(3-aminopropyl)naphthalen-2-ol?
The canonical SMILES for 3-(3-aminopropyl)naphthalen-2-ol is NCCCc1cc2ccccc2cc1O.
What is the InChIKey of 3-(3-aminopropyl)naphthalen-2-ol?
The InChIKey is LWKIQXCQAPMOIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO/c14-7-3-6-12-8-10-4-1-2-5-11(10)9-13(12)15/h1-2,4-5,8-9,15H,3,6-7,14H2.
What are the key properties of 3-(3-aminopropyl)naphthalen-2-ol?
3-(3-aminopropyl)naphthalen-2-ol has a molecular weight of 201.27 g/mol, XLogP of 2.44, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-aminopropyl)naphthalen-2-ol is sourced from PubChem (CID 117290164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).