2-(3-methoxyphenyl)-4-phenyl-1,3-thiazol-5-amine

C16H14N2OS — CID 71085692

IUPAC2-(3-methoxyphenyl)-4-phenyl-1,3-thiazol-5-amine
SMILESCOc1cccc(-c2nc(-c3ccccc3)c(N)s2)c1
InChIInChI=1S/C16H14N2OS/c1-19-13-9-5-8-12(10-13)16-18-14(15(17)20-16)11-6-3-2-4-7-11/h2-10H,17H2,1H3
InChIKeyJCNXUQYXPNAPKI-UHFFFAOYSA-N
MW282.37 g/mol
LogP4.07
Rot. Bonds3

About 2-(3-methoxyphenyl)-4-phenyl-1,3-thiazol-5-amine

2-(3-methoxyphenyl)-4-phenyl-1,3-thiazol-5-amine (PubChem CID 71085692) has the molecular formula C16H14N2OS and a molecular weight of 282.37 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-4-phenyl-1,3-thiazol-5-amine.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-4-phenyl-1,3-thiazol-5-amine
PubChem CID71085692
Molecular FormulaC16H14N2OS
Molecular Weight282.37 g/mol
Exact Mass282.08
IUPAC Name2-(3-methoxyphenyl)-4-phenyl-1,3-thiazol-5-amine
SMILESCOc1cccc(-c2nc(-c3ccccc3)c(N)s2)c1
InChIInChI=1S/C16H14N2OS/c1-19-13-9-5-8-12(10-13)16-18-14(15(17)20-16)11-6-3-2-4-7-11/h2-10H,17H2,1H3
InChIKeyJCNXUQYXPNAPKI-UHFFFAOYSA-N
XLogP4.07
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.37
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(3-methylphenyl)-2-phenyl-1,3-thiazol-5-amine
CID 55034297
2-chloro-5-(3-methoxyphenyl)-4-phenyl-1,3-thiazole
CID 54307577
4-(3,5-dichlorophenyl)-2-phenyl-1,3-thiazol-5-amine
CID 63469685
5-methoxy-2-(3-methoxyphenyl)-4-methyl-1,3-thiazole
CID 116887585
2,3,5,6-tetrakis(3-methoxyphenyl)pyrazine
CID 132941107
2-(3-methoxyphenyl)-4-phenyl-N-pyridin-3-yl-1,3-thiazole-5-carboxamide
CID 17409593
3-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]aniline
CID 7148555
2-amino-4-(3-methoxyphenyl)-6-phenylpyrimidine-5-carbonitrile
CID 163196347
2-[2-(3-methoxyphenyl)-4-pyridin-3-yl-1,3-thiazol-5-yl]ethanamine
CID 93216550
2-phenyl-4-(2,4,6-trimethylphenyl)-1,3-thiazol-5-amine
CID 63469518
3-(3-methoxyphenyl)-1,2,4-thiadiazol-5-amine;hydrochloride
CID 75485647
4-[3-(difluoromethyl)phenyl]-2-phenyl-1,3-thiazol-5-amine
CID 115528326

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-4-phenyl-1,3-thiazol-5-amine?
The IUPAC name of 2-(3-methoxyphenyl)-4-phenyl-1,3-thiazol-5-amine (CID 71085692) is 2-(3-methoxyphenyl)-4-phenyl-1,3-thiazol-5-amine.
What is the SMILES notation for 2-(3-methoxyphenyl)-4-phenyl-1,3-thiazol-5-amine?
The canonical SMILES for 2-(3-methoxyphenyl)-4-phenyl-1,3-thiazol-5-amine is COc1cccc(-c2nc(-c3ccccc3)c(N)s2)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-4-phenyl-1,3-thiazol-5-amine?
The InChIKey is JCNXUQYXPNAPKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2OS/c1-19-13-9-5-8-12(10-13)16-18-14(15(17)20-16)11-6-3-2-4-7-11/h2-10H,17H2,1H3.
What are the key properties of 2-(3-methoxyphenyl)-4-phenyl-1,3-thiazol-5-amine?
2-(3-methoxyphenyl)-4-phenyl-1,3-thiazol-5-amine has a molecular weight of 282.37 g/mol, XLogP of 4.07, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-4-phenyl-1,3-thiazol-5-amine is sourced from PubChem (CID 71085692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).