4-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)-1,3-thiazol-2-amine

C14H16N2OS — CID 43137896

IUPAC4-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)-1,3-thiazol-2-amine
SMILESNc1nc(COC2CCCc3ccccc32)cs1
InChIInChI=1S/C14H16N2OS/c15-14-16-11(9-18-14)8-17-13-7-3-5-10-4-1-2-6-12(10)13/h1-2,4,6,9,13H,3,5,7-8H2,(H2,15,16)
InChIKeyIKEVICJQVXSXPC-UHFFFAOYSA-N
MW260.36 g/mol
LogP3.32
Rot. Bonds3

About 4-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)-1,3-thiazol-2-amine

4-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)-1,3-thiazol-2-amine (PubChem CID 43137896) has the molecular formula C14H16N2OS and a molecular weight of 260.36 g/mol. Its IUPAC name is 4-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)-1,3-thiazol-2-amine
PubChem CID43137896
Molecular FormulaC14H16N2OS
Molecular Weight260.36 g/mol
Exact Mass260.10
IUPAC Name4-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)-1,3-thiazol-2-amine
SMILESNc1nc(COC2CCCc3ccccc32)cs1
InChIInChI=1S/C14H16N2OS/c15-14-16-11(9-18-14)8-17-13-7-3-5-10-4-1-2-6-12(10)13/h1-2,4,6,9,13H,3,5,7-8H2,(H2,15,16)
InChIKeyIKEVICJQVXSXPC-UHFFFAOYSA-N
XLogP3.32
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(chloromethyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)-1,3-thiazole
CID 43138207
[5-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)thiophen-2-yl]methanamine
CID 107558127
6-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)pyrimidin-4-amine
CID 80654849
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
[5-methyl-4-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)furan-2-yl]methanamine
CID 62457498
3,5-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)pyridin-4-amine
CID 103183059
[2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-thiazol-4-yl]methanamine
CID 63250998
1-(2-chloroethoxy)-1,2,3,4-tetrahydronaphthalene
CID 43135615
2-[2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)ethyl]aniline
CID 62497436
4-[2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)ethyl]aniline
CID 43519719
6-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyrazin-2-amine
CID 80646899

Frequently Asked Questions

What is the IUPAC name of 4-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)-1,3-thiazol-2-amine (CID 43137896) is 4-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)-1,3-thiazol-2-amine is Nc1nc(COC2CCCc3ccccc32)cs1.
What is the InChIKey of 4-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)-1,3-thiazol-2-amine?
The InChIKey is IKEVICJQVXSXPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2OS/c15-14-16-11(9-18-14)8-17-13-7-3-5-10-4-1-2-6-12(10)13/h1-2,4,6,9,13H,3,5,7-8H2,(H2,15,16).
What are the key properties of 4-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)-1,3-thiazol-2-amine?
4-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)-1,3-thiazol-2-amine has a molecular weight of 260.36 g/mol, XLogP of 3.32, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 43137896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).