N-tert-butyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-2-amine

C15H21N3OS — CID 115498631

IUPACN-tert-butyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-2-amine
SMILESCc1ncsc1CCOc1cccc(NC(C)(C)C)n1
InChIInChI=1S/C15H21N3OS/c1-11-12(20-10-16-11)8-9-19-14-7-5-6-13(17-14)18-15(2,3)4/h5-7,10H,8-9H2,1-4H3,(H,17,18)
InChIKeyVPOKZZRZKKYLLW-UHFFFAOYSA-N
MW291.42 g/mol
LogP3.68
Rot. Bonds5

About N-tert-butyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-2-amine

N-tert-butyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-2-amine (PubChem CID 115498631) has the molecular formula C15H21N3OS and a molecular weight of 291.42 g/mol. Its IUPAC name is N-tert-butyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-2-amine.

Molecular Properties

Compound NameN-tert-butyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-2-amine
PubChem CID115498631
Molecular FormulaC15H21N3OS
Molecular Weight291.42 g/mol
Exact Mass291.14
IUPAC NameN-tert-butyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-2-amine
SMILESCc1ncsc1CCOc1cccc(NC(C)(C)C)n1
InChIInChI=1S/C15H21N3OS/c1-11-12(20-10-16-11)8-9-19-14-7-5-6-13(17-14)18-15(2,3)4/h5-7,10H,8-9H2,1-4H3,(H,17,18)
InChIKeyVPOKZZRZKKYLLW-UHFFFAOYSA-N
XLogP3.68
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.42
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-butoxy-N-tert-butylpyridin-2-amine
CID 115498673
4-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]-N-propylpyrimidin-2-amine
CID 80859119
N-tert-butyl-6-(2,2,2-trifluoroethoxy)pyridin-2-amine
CID 115498610
N-ethyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]-2-propan-2-ylpyrimidin-4-amine
CID 80955893
6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]-2-propoxypyridin-3-amine
CID 43262332
O-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]hydroxylamine
CID 11228942
N-tert-butyl-6-(4-ethoxyphenoxy)pyridin-2-amine
CID 115498695
1-[3-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]phenyl]ethanamine
CID 62072174
[5-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyrazin-2-yl]methanol
CID 107373137
3-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]benzonitrile
CID 62071333
N-tert-butyl-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]butan-1-amine
CID 55077594
5-[2-[(6-chloro-2-pyridinyl)methoxy]ethyl]-4-methyl-1,3-thiazole
CID 79240432

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-2-amine?
The IUPAC name of N-tert-butyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-2-amine (CID 115498631) is N-tert-butyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-2-amine.
What is the SMILES notation for N-tert-butyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-2-amine?
The canonical SMILES for N-tert-butyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-2-amine is Cc1ncsc1CCOc1cccc(NC(C)(C)C)n1.
What is the InChIKey of N-tert-butyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-2-amine?
The InChIKey is VPOKZZRZKKYLLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3OS/c1-11-12(20-10-16-11)8-9-19-14-7-5-6-13(17-14)18-15(2,3)4/h5-7,10H,8-9H2,1-4H3,(H,17,18).
What are the key properties of N-tert-butyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-2-amine?
N-tert-butyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-2-amine has a molecular weight of 291.42 g/mol, XLogP of 3.68, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-2-amine is sourced from PubChem (CID 115498631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).