2-(2-methoxynaphthalen-1-yl)-1-pyridin-4-ylethanamine

C18H18N2O — CID 21148412

IUPAC2-(2-methoxynaphthalen-1-yl)-1-pyridin-4-ylethanamine
SMILESCOc1ccc2ccccc2c1CC(N)c1ccncc1
InChIInChI=1S/C18H18N2O/c1-21-18-7-6-13-4-2-3-5-15(13)16(18)12-17(19)14-8-10-20-11-9-14/h2-11,17H,12,19H2,1H3
InChIKeyAOLPISWWGNVYBR-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.49
Rot. Bonds4

About 2-(2-methoxynaphthalen-1-yl)-1-pyridin-4-ylethanamine

2-(2-methoxynaphthalen-1-yl)-1-pyridin-4-ylethanamine (PubChem CID 21148412) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is 2-(2-methoxynaphthalen-1-yl)-1-pyridin-4-ylethanamine.

Molecular Properties

Compound Name2-(2-methoxynaphthalen-1-yl)-1-pyridin-4-ylethanamine
PubChem CID21148412
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC Name2-(2-methoxynaphthalen-1-yl)-1-pyridin-4-ylethanamine
SMILESCOc1ccc2ccccc2c1CC(N)c1ccncc1
InChIInChI=1S/C18H18N2O/c1-21-18-7-6-13-4-2-3-5-15(13)16(18)12-17(19)14-8-10-20-11-9-14/h2-11,17H,12,19H2,1H3
InChIKeyAOLPISWWGNVYBR-UHFFFAOYSA-N
XLogP3.49
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxynaphthalen-1-yl)butan-2-amine;hydrochloride
CID 170888490
(2R)-1-(2-methoxynaphthalen-1-yl)propan-2-ol
CID 92532795
2-naphthalen-1-yl-1-pyridin-4-ylethanamine
CID 61079955
2-(4-fluorophenyl)-3-(2-methoxynaphthalen-1-yl)propan-1-amine
CID 83973798
(1S)-1-(2-methoxynaphthalen-1-yl)propane-1,3-diamine;hydrochloride
CID 171232538
(1R)-2-cyclopropyl-1-(2-methoxynaphthalen-1-yl)ethanamine;hydrochloride
CID 171212937
1-(2,3-dimethoxynaphthalen-1-yl)propan-2-amine
CID 170891238
1-phenyl-2-pyridin-4-ylethanamine
CID 10465342
(2S)-2-amino-N-[(2-methoxynaphthalen-1-yl)methyl]-3,3-dimethylbutanamide;hydrochloride
CID 119709365
[4-[(2-methoxynaphthalen-1-yl)methyl]piperazin-4-ium-1-yl]-pyridin-4-ylmethanone
CID 6967992
methyl 2-[(2-methoxynaphthalen-1-yl)methylamino]propanoate
CID 60780634
[amino-(2-methoxynaphthalen-1-yl)methylidene]azanium
CID 6347163

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxynaphthalen-1-yl)-1-pyridin-4-ylethanamine?
The IUPAC name of 2-(2-methoxynaphthalen-1-yl)-1-pyridin-4-ylethanamine (CID 21148412) is 2-(2-methoxynaphthalen-1-yl)-1-pyridin-4-ylethanamine.
What is the SMILES notation for 2-(2-methoxynaphthalen-1-yl)-1-pyridin-4-ylethanamine?
The canonical SMILES for 2-(2-methoxynaphthalen-1-yl)-1-pyridin-4-ylethanamine is COc1ccc2ccccc2c1CC(N)c1ccncc1.
What is the InChIKey of 2-(2-methoxynaphthalen-1-yl)-1-pyridin-4-ylethanamine?
The InChIKey is AOLPISWWGNVYBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-21-18-7-6-13-4-2-3-5-15(13)16(18)12-17(19)14-8-10-20-11-9-14/h2-11,17H,12,19H2,1H3.
What are the key properties of 2-(2-methoxynaphthalen-1-yl)-1-pyridin-4-ylethanamine?
2-(2-methoxynaphthalen-1-yl)-1-pyridin-4-ylethanamine has a molecular weight of 278.36 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxynaphthalen-1-yl)-1-pyridin-4-ylethanamine is sourced from PubChem (CID 21148412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).