2-naphthalen-1-yl-1-pyridin-4-ylethanamine

C17H16N2 — CID 61079955

IUPAC2-naphthalen-1-yl-1-pyridin-4-ylethanamine
SMILESNC(Cc1cccc2ccccc12)c1ccncc1
InChIInChI=1S/C17H16N2/c18-17(14-8-10-19-11-9-14)12-15-6-3-5-13-4-1-2-7-16(13)15/h1-11,17H,12,18H2
InChIKeyKASQWBTXGKITQK-UHFFFAOYSA-N
MW248.33 g/mol
LogP3.48
Rot. Bonds3

About 2-naphthalen-1-yl-1-pyridin-4-ylethanamine

2-naphthalen-1-yl-1-pyridin-4-ylethanamine (PubChem CID 61079955) has the molecular formula C17H16N2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-naphthalen-1-yl-1-pyridin-4-ylethanamine.

Molecular Properties

Compound Name2-naphthalen-1-yl-1-pyridin-4-ylethanamine
PubChem CID61079955
Molecular FormulaC17H16N2
Molecular Weight248.33 g/mol
Exact Mass248.13
IUPAC Name2-naphthalen-1-yl-1-pyridin-4-ylethanamine
SMILESNC(Cc1cccc2ccccc12)c1ccncc1
InChIInChI=1S/C17H16N2/c18-17(14-8-10-19-11-9-14)12-15-6-3-5-13-4-1-2-7-16(13)15/h1-11,17H,12,18H2
InChIKeyKASQWBTXGKITQK-UHFFFAOYSA-N
XLogP3.48
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-naphthalen-1-yl-1-pyridin-4-ylethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(3,4-dichlorophenyl)-2-naphthalen-1-ylethanamine
CID 63527360
1-(3,5-dimethylphenyl)-2-naphthalen-1-ylethanamine
CID 63527361
2-(2-methoxynaphthalen-1-yl)-1-pyridin-4-ylethanamine
CID 21148412
1-(2-methylpyrimidin-4-yl)-2-naphthalen-1-ylethanamine
CID 115530277
1-(5-methylthiophen-3-yl)-2-naphthalen-1-ylethanamine
CID 105155456
1-(furan-2-yl)-2-naphthalen-1-ylethanamine
CID 61079401
1-(4-fluoro-3-methylphenyl)-2-naphthalen-1-ylethanamine
CID 62600642
1-(3-chloro-4-fluorophenyl)-2-naphthalen-1-ylethanamine
CID 63418657
1-(5-methylthiophen-2-yl)-2-naphthalen-1-ylethanamine
CID 61079214
1-phenyl-2-pyridin-4-ylethanamine
CID 10465342
3-naphthalen-1-yl-1-phenylpropan-1-amine
CID 43370421
(2S)-1-naphthalen-1-ylbutan-2-amine
CID 178163209

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yl-1-pyridin-4-ylethanamine?
The IUPAC name of 2-naphthalen-1-yl-1-pyridin-4-ylethanamine (CID 61079955) is 2-naphthalen-1-yl-1-pyridin-4-ylethanamine.
What is the SMILES notation for 2-naphthalen-1-yl-1-pyridin-4-ylethanamine?
The canonical SMILES for 2-naphthalen-1-yl-1-pyridin-4-ylethanamine is NC(Cc1cccc2ccccc12)c1ccncc1.
What is the InChIKey of 2-naphthalen-1-yl-1-pyridin-4-ylethanamine?
The InChIKey is KASQWBTXGKITQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2/c18-17(14-8-10-19-11-9-14)12-15-6-3-5-13-4-1-2-7-16(13)15/h1-11,17H,12,18H2.
What are the key properties of 2-naphthalen-1-yl-1-pyridin-4-ylethanamine?
2-naphthalen-1-yl-1-pyridin-4-ylethanamine has a molecular weight of 248.33 g/mol, XLogP of 3.48, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yl-1-pyridin-4-ylethanamine is sourced from PubChem (CID 61079955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).