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

C14H12N2OS — CID 973573

IUPAC4-(naphthalen-2-yloxymethyl)-1,3-thiazol-2-amine
SMILESNc1nc(COc2ccc3ccccc3c2)cs1
InChIInChI=1S/C14H12N2OS/c15-14-16-12(9-18-14)8-17-13-6-5-10-3-1-2-4-11(10)7-13/h1-7,9H,8H2,(H2,15,16)
InChIKeyRJXDEFFGHIEMFG-UHFFFAOYSA-N
MW256.33 g/mol
LogP3.46
Rot. Bonds3

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

4-(naphthalen-2-yloxymethyl)-1,3-thiazol-2-amine (PubChem CID 973573) has the molecular formula C14H12N2OS and a molecular weight of 256.33 g/mol. Its IUPAC name is 4-(naphthalen-2-yloxymethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(naphthalen-2-yloxymethyl)-1,3-thiazol-2-amine
PubChem CID973573
Molecular FormulaC14H12N2OS
Molecular Weight256.33 g/mol
Exact Mass256.07
IUPAC Name4-(naphthalen-2-yloxymethyl)-1,3-thiazol-2-amine
SMILESNc1nc(COc2ccc3ccccc3c2)cs1
InChIInChI=1S/C14H12N2OS/c15-14-16-12(9-18-14)8-17-13-6-5-10-3-1-2-4-11(10)7-13/h1-7,9H,8H2,(H2,15,16)
InChIKeyRJXDEFFGHIEMFG-UHFFFAOYSA-N
XLogP3.46
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.33
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(Phenoxymethyl)-1,3-thiazol-2-amine
CID 2050028
4-(2-(p-Tolyloxy)ethyl)thiazol-2-amine
CID 2050018
4-[(2-Methylphenoxy)methyl]-1,3-thiazol-2-amine
CID 4985772
4-(2-Methoxy-1-naphthyl)-1,3-thiazol-2-amine
CID 4678909
{2-[2-(Naphthalen-2-yloxy)-acetylamino]-thiazol-4-yl}-acetic acid ethyl ester
CID 3146020
4-[(4-Methylphenoxy)methyl]-1,3-thiazol-2-amine
CID 3865674
N-{4-[(2-naphthyloxy)methyl]-1,3-thiazol-2-yl}acetamide
CID 830442
4-(1-(4-Methoxyphenyl)-2-phenylethyl)thiazol-2-amine
CID 11702315
4-Methyl-2-[7-(2-naphthyloxy)heptyl]thiazole
CID 5272773
4-(Phenoxymethyl)-1,3-thiazol-2-amine hydrochloride
CID 134690878
2-(3,4-dimethylphenoxy)-N-(4-methylthiazol-2-yl)acetamide
CID 2679352
N-{4-[(methylthio)methyl]-1,3-thiazol-2-yl}(2-naphthyloxy)acetamide
CID 16850012

Frequently Asked Questions

What is the IUPAC name of 4-(naphthalen-2-yloxymethyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(naphthalen-2-yloxymethyl)-1,3-thiazol-2-amine (CID 973573) is 4-(naphthalen-2-yloxymethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(naphthalen-2-yloxymethyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(naphthalen-2-yloxymethyl)-1,3-thiazol-2-amine is Nc1nc(COc2ccc3ccccc3c2)cs1.
What is the InChIKey of 4-(naphthalen-2-yloxymethyl)-1,3-thiazol-2-amine?
The InChIKey is RJXDEFFGHIEMFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2OS/c15-14-16-12(9-18-14)8-17-13-6-5-10-3-1-2-4-11(10)7-13/h1-7,9H,8H2,(H2,15,16).
What are the key properties of 4-(naphthalen-2-yloxymethyl)-1,3-thiazol-2-amine?
4-(naphthalen-2-yloxymethyl)-1,3-thiazol-2-amine has a molecular weight of 256.33 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(naphthalen-2-yloxymethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 973573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).