3-(naphthalen-1-ylmethoxy)pyridin-2-amine

C16H14N2O — CID 5326871

IUPAC3-(naphthalen-1-ylmethoxy)pyridin-2-amine
SMILESNc1ncccc1OCc1cccc2ccccc12
InChIInChI=1S/C16H14N2O/c17-16-15(9-4-10-18-16)19-11-13-7-3-6-12-5-1-2-8-14(12)13/h1-10H,11H2,(H2,17,18)
InChIKeySZANYTFSQVBOBA-UHFFFAOYSA-N
MW250.30 g/mol
LogP3.40
Rot. Bonds3

About 3-(naphthalen-1-ylmethoxy)pyridin-2-amine

3-(naphthalen-1-ylmethoxy)pyridin-2-amine (PubChem CID 5326871) has the molecular formula C16H14N2O and a molecular weight of 250.30 g/mol. Its IUPAC name is 3-(naphthalen-1-ylmethoxy)pyridin-2-amine.

Molecular Properties

Compound Name3-(naphthalen-1-ylmethoxy)pyridin-2-amine
PubChem CID5326871
Molecular FormulaC16H14N2O
Molecular Weight250.30 g/mol
Exact Mass250.11
IUPAC Name3-(naphthalen-1-ylmethoxy)pyridin-2-amine
SMILESNc1ncccc1OCc1cccc2ccccc12
InChIInChI=1S/C16H14N2O/c17-16-15(9-4-10-18-16)19-11-13-7-3-6-12-5-1-2-8-14(12)13/h1-10H,11H2,(H2,17,18)
InChIKeySZANYTFSQVBOBA-UHFFFAOYSA-N
XLogP3.40
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_OC_no_alk_C(3)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(naphthalen-1-ylmethoxy)pyridin-2-amine?
The IUPAC name of 3-(naphthalen-1-ylmethoxy)pyridin-2-amine (CID 5326871) is 3-(naphthalen-1-ylmethoxy)pyridin-2-amine.
What is the SMILES notation for 3-(naphthalen-1-ylmethoxy)pyridin-2-amine?
The canonical SMILES for 3-(naphthalen-1-ylmethoxy)pyridin-2-amine is Nc1ncccc1OCc1cccc2ccccc12.
What is the InChIKey of 3-(naphthalen-1-ylmethoxy)pyridin-2-amine?
The InChIKey is SZANYTFSQVBOBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O/c17-16-15(9-4-10-18-16)19-11-13-7-3-6-12-5-1-2-8-14(12)13/h1-10H,11H2,(H2,17,18).
What are the key properties of 3-(naphthalen-1-ylmethoxy)pyridin-2-amine?
3-(naphthalen-1-ylmethoxy)pyridin-2-amine has a molecular weight of 250.30 g/mol, XLogP of 3.40, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(naphthalen-1-ylmethoxy)pyridin-2-amine is sourced from PubChem (CID 5326871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).