N-ethyl-N-methyl-4-phenyl-2-pyridin-3-yl-1,3-thiazol-5-amine

C17H17N3S — CID 126635045

IUPACN-ethyl-N-methyl-4-phenyl-2-pyridin-3-yl-1,3-thiazol-5-amine
SMILESCCN(C)c1sc(-c2cccnc2)nc1-c1ccccc1
InChIInChI=1S/C17H17N3S/c1-3-20(2)17-15(13-8-5-4-6-9-13)19-16(21-17)14-10-7-11-18-12-14/h4-12H,3H2,1-2H3
InChIKeyZKIQYJRZCXOVEL-UHFFFAOYSA-N
MW295.41 g/mol
LogP4.33
Rot. Bonds4

About N-ethyl-N-methyl-4-phenyl-2-pyridin-3-yl-1,3-thiazol-5-amine

N-ethyl-N-methyl-4-phenyl-2-pyridin-3-yl-1,3-thiazol-5-amine (PubChem CID 126635045) has the molecular formula C17H17N3S and a molecular weight of 295.41 g/mol. Its IUPAC name is N-ethyl-N-methyl-4-phenyl-2-pyridin-3-yl-1,3-thiazol-5-amine.

Molecular Properties

Compound NameN-ethyl-N-methyl-4-phenyl-2-pyridin-3-yl-1,3-thiazol-5-amine
PubChem CID126635045
Molecular FormulaC17H17N3S
Molecular Weight295.41 g/mol
Exact Mass295.11
IUPAC NameN-ethyl-N-methyl-4-phenyl-2-pyridin-3-yl-1,3-thiazol-5-amine
SMILESCCN(C)c1sc(-c2cccnc2)nc1-c1ccccc1
InChIInChI=1S/C17H17N3S/c1-3-20(2)17-15(13-8-5-4-6-9-13)19-16(21-17)14-10-7-11-18-12-14/h4-12H,3H2,1-2H3
InChIKeyZKIQYJRZCXOVEL-UHFFFAOYSA-N
XLogP4.33
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.41
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-bromo-N-ethyl-N-methyl-2-pyridin-3-yl-1,3-thiazol-5-amine
CID 123176105
N-ethyl-2,2,2-trifluoro-N-(4-phenyl-2-pyridin-3-yl-1,3-thiazol-5-yl)acetamide
CID 59580833
N,N-dimethyl-4-phenyl-2-pyridin-3-yl-1,3-thiazole-5-carboxamide;hydrochloride
CID 3040028
4-phenyl-2-pyridin-3-yl-1,3-thiazole-5-carboxylic acid
CID 73012806
N-[(4-phenyl-2-pyridin-3-yl-1,3-thiazol-5-yl)methyl]aniline
CID 53494006
N-[(5-phenyl-2-pyridin-3-yl-1,3-thiazol-4-yl)methyl]ethanamine
CID 64717713
2-(2,4-dipyridin-3-yl-1,3-thiazol-5-yl)acetic acid
CID 82069424
N-[4-(iodomethyl)-2-pyridin-3-yl-1,3-thiazol-5-yl]-N-methyl-3-methylsulfanylpropanamide
CID 89447201
N-ethyl-5-methyl-N-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1-phenylpyrazole-4-carboxamide
CID 70833297
tert-butyl N-ethyl-N-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)carbamate
CID 59580635
N-(4-chloro-2-pyridin-3-yl-1,3-thiazol-5-yl)-N-ethylprop-2-enamide
CID 59580463
N-(4-chloro-2-pyridin-3-yl-1,3-thiazol-5-yl)-N-methyl-2-sulfanylacetamide
CID 89012295

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-4-phenyl-2-pyridin-3-yl-1,3-thiazol-5-amine?
The IUPAC name of N-ethyl-N-methyl-4-phenyl-2-pyridin-3-yl-1,3-thiazol-5-amine (CID 126635045) is N-ethyl-N-methyl-4-phenyl-2-pyridin-3-yl-1,3-thiazol-5-amine.
What is the SMILES notation for N-ethyl-N-methyl-4-phenyl-2-pyridin-3-yl-1,3-thiazol-5-amine?
The canonical SMILES for N-ethyl-N-methyl-4-phenyl-2-pyridin-3-yl-1,3-thiazol-5-amine is CCN(C)c1sc(-c2cccnc2)nc1-c1ccccc1.
What is the InChIKey of N-ethyl-N-methyl-4-phenyl-2-pyridin-3-yl-1,3-thiazol-5-amine?
The InChIKey is ZKIQYJRZCXOVEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3S/c1-3-20(2)17-15(13-8-5-4-6-9-13)19-16(21-17)14-10-7-11-18-12-14/h4-12H,3H2,1-2H3.
What are the key properties of N-ethyl-N-methyl-4-phenyl-2-pyridin-3-yl-1,3-thiazol-5-amine?
N-ethyl-N-methyl-4-phenyl-2-pyridin-3-yl-1,3-thiazol-5-amine has a molecular weight of 295.41 g/mol, XLogP of 4.33, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-4-phenyl-2-pyridin-3-yl-1,3-thiazol-5-amine is sourced from PubChem (CID 126635045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).