4-[2-ethyl-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]pyridin-2-amine

C17H17N3OS — CID 11493332

IUPAC4-[2-ethyl-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]pyridin-2-amine
SMILESCCc1nc(-c2ccc(OC)cc2)c(-c2ccnc(N)c2)s1
InChIInChI=1S/C17H17N3OS/c1-3-15-20-16(11-4-6-13(21-2)7-5-11)17(22-15)12-8-9-19-14(18)10-12/h4-10H,3H2,1-2H3,(H2,18,19)
InChIKeyQEZMKPPIRJOGGO-UHFFFAOYSA-N
MW311.41 g/mol
LogP4.03
Rot. Bonds4

About 4-[2-ethyl-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]pyridin-2-amine

4-[2-ethyl-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]pyridin-2-amine (PubChem CID 11493332) has the molecular formula C17H17N3OS and a molecular weight of 311.41 g/mol. Its IUPAC name is 4-[2-ethyl-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]pyridin-2-amine.

Molecular Properties

Compound Name4-[2-ethyl-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]pyridin-2-amine
PubChem CID11493332
Molecular FormulaC17H17N3OS
Molecular Weight311.41 g/mol
Exact Mass311.11
IUPAC Name4-[2-ethyl-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]pyridin-2-amine
SMILESCCc1nc(-c2ccc(OC)cc2)c(-c2ccnc(N)c2)s1
InChIInChI=1S/C17H17N3OS/c1-3-15-20-16(11-4-6-13(21-2)7-5-11)17(22-15)12-8-9-19-14(18)10-12/h4-10H,3H2,1-2H3,(H2,18,19)
InChIKeyQEZMKPPIRJOGGO-UHFFFAOYSA-N
XLogP4.03
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.41
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[2-ethyl-4-(4-methylphenyl)-1,3-thiazol-5-yl]pyridin-2-amine
CID 11536681
2-[4,5-bis(4-methoxyphenyl)-1,3-thiazol-2-yl]ethanamine
CID 19748887
2-ethyl-4-(4-methoxyphenyl)-1,3-thiazole-5-carboxylic acid
CID 82226862
2-[[4,5-bis(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]guanidine;hydrochloride
CID 19757960
5-(2-chloro-4-pyridinyl)-2-ethyl-4-(3-methylphenyl)-1,3-thiazole
CID 11674063
4-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]pyridin-2-amine
CID 71401542
4-(4-methoxyphenyl)-5-(2-methylsulfanylpyrimidin-4-yl)-1,3-thiazol-2-amine
CID 15603563
[4-[2-ethyl-4-(4-methylsulfanylphenyl)-1,3-thiazol-5-yl]-2-pyridinyl]imino-methyl-oxo-phenyl-λ6-sulfane
CID 23725870
2-ethyl-4-(3-methylphenyl)-5-(2-pyrrolidin-1-yl-4-pyridinyl)-1,3-thiazole
CID 11710028
[4-[2-ethyl-4-(4-fluorophenyl)-1,3-thiazol-5-yl]-2-pyridinyl]imino-methyl-oxo-phenyl-λ6-sulfane;methanesulfonic acid
CID 23725225
4-[4-(difluoromethoxy)phenyl]-2-ethyl-1,3-thiazol-5-amine
CID 62082904
4-(3,4-diethylphenyl)pyridin-2-amine
CID 102821959

Frequently Asked Questions

What is the IUPAC name of 4-[2-ethyl-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]pyridin-2-amine?
The IUPAC name of 4-[2-ethyl-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]pyridin-2-amine (CID 11493332) is 4-[2-ethyl-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]pyridin-2-amine.
What is the SMILES notation for 4-[2-ethyl-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]pyridin-2-amine?
The canonical SMILES for 4-[2-ethyl-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]pyridin-2-amine is CCc1nc(-c2ccc(OC)cc2)c(-c2ccnc(N)c2)s1.
What is the InChIKey of 4-[2-ethyl-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]pyridin-2-amine?
The InChIKey is QEZMKPPIRJOGGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3OS/c1-3-15-20-16(11-4-6-13(21-2)7-5-11)17(22-15)12-8-9-19-14(18)10-12/h4-10H,3H2,1-2H3,(H2,18,19).
What are the key properties of 4-[2-ethyl-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]pyridin-2-amine?
4-[2-ethyl-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]pyridin-2-amine has a molecular weight of 311.41 g/mol, XLogP of 4.03, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-ethyl-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]pyridin-2-amine is sourced from PubChem (CID 11493332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).