3,5-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)pyridin-4-amine

C18H22N2O — CID 103183059

IUPAC3,5-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)pyridin-4-amine
SMILESCc1cnc(COC2CCCc3ccccc32)c(C)c1N
InChIInChI=1S/C18H22N2O/c1-12-10-20-16(13(2)18(12)19)11-21-17-9-5-7-14-6-3-4-8-15(14)17/h3-4,6,8,10,17H,5,7,9,11H2,1-2H3,(H2,19,20)
InChIKeyJEIKSGJMZYSMTE-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.87
Rot. Bonds3

About 3,5-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)pyridin-4-amine

3,5-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)pyridin-4-amine (PubChem CID 103183059) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is 3,5-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)pyridin-4-amine.

Molecular Properties

Compound Name3,5-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)pyridin-4-amine
PubChem CID103183059
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC Name3,5-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)pyridin-4-amine
SMILESCc1cnc(COC2CCCc3ccccc32)c(C)c1N
InChIInChI=1S/C18H22N2O/c1-12-10-20-16(13(2)18(12)19)11-21-17-9-5-7-14-6-3-4-8-15(14)17/h3-4,6,8,10,17H,5,7,9,11H2,1-2H3,(H2,19,20)
InChIKeyJEIKSGJMZYSMTE-UHFFFAOYSA-N
XLogP3.87
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)pyrimidin-4-amine
CID 80654849
4-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)-1,3-thiazol-2-amine
CID 43137896
[5-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)thiophen-2-yl]methanamine
CID 107558127
5-chloro-2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)aniline
CID 62100757
4-fluoro-2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)aniline
CID 43443892
N-methyl-4-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)pyridin-2-amine
CID 62465313
[5-methyl-4-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)furan-2-yl]methanamine
CID 62457498
3,5-dimethyl-2-(1,2,4,5-tetrahydro-3-benzazepin-3-ylmethyl)pyridin-4-amine
CID 103182427
1-(2-chloroethoxy)-1,2,3,4-tetrahydronaphthalene
CID 43135615
3,5-dimethyl-2-(1-phenylethoxymethyl)pyridin-4-amine
CID 103183068
2-[2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)ethyl]aniline
CID 62497436
2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)piperidine
CID 54943160

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)pyridin-4-amine?
The IUPAC name of 3,5-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)pyridin-4-amine (CID 103183059) is 3,5-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)pyridin-4-amine.
What is the SMILES notation for 3,5-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)pyridin-4-amine?
The canonical SMILES for 3,5-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)pyridin-4-amine is Cc1cnc(COC2CCCc3ccccc32)c(C)c1N.
What is the InChIKey of 3,5-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)pyridin-4-amine?
The InChIKey is JEIKSGJMZYSMTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c1-12-10-20-16(13(2)18(12)19)11-21-17-9-5-7-14-6-3-4-8-15(14)17/h3-4,6,8,10,17H,5,7,9,11H2,1-2H3,(H2,19,20).
What are the key properties of 3,5-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)pyridin-4-amine?
3,5-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)pyridin-4-amine has a molecular weight of 282.39 g/mol, XLogP of 3.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)pyridin-4-amine is sourced from PubChem (CID 103183059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).