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

C17H18N4OS — CID 75498025

IUPAC4-methoxy-N-[1-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)ethyl]pyridin-2-amine
SMILESCOc1ccnc(NC(C)c2sc(-c3cccnc3)nc2C)c1
InChIInChI=1S/C17H18N4OS/c1-11(20-15-9-14(22-3)6-8-19-15)16-12(2)21-17(23-16)13-5-4-7-18-10-13/h4-11H,1-3H3,(H,19,20)
InChIKeyQKVIEWATRIOBRO-UHFFFAOYSA-N
MW326.43 g/mol
LogP4.09
Rot. Bonds5

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

4-methoxy-N-[1-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)ethyl]pyridin-2-amine (PubChem CID 75498025) has the molecular formula C17H18N4OS and a molecular weight of 326.43 g/mol. Its IUPAC name is 4-methoxy-N-[1-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name4-methoxy-N-[1-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)ethyl]pyridin-2-amine
PubChem CID75498025
Molecular FormulaC17H18N4OS
Molecular Weight326.43 g/mol
Exact Mass326.12
IUPAC Name4-methoxy-N-[1-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)ethyl]pyridin-2-amine
SMILESCOc1ccnc(NC(C)c2sc(-c3cccnc3)nc2C)c1
InChIInChI=1S/C17H18N4OS/c1-11(20-15-9-14(22-3)6-8-19-15)16-12(2)21-17(23-16)13-5-4-7-18-10-13/h4-11H,1-3H3,(H,19,20)
InChIKeyQKVIEWATRIOBRO-UHFFFAOYSA-N
XLogP4.09
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.43
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-methoxy-N-[1-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)ethyl]pyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methyl-1-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)ethanamine
CID 61287607
N-[1-[2-(4-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]ethyl]pyridin-2-amine
CID 133312372
3-methoxy-N-[(1S)-1-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)ethyl]propan-1-amine
CID 100648662
(1S)-1-(2,5-dimethylfuran-3-yl)-N-[(1R)-1-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)ethyl]ethanamine
CID 97230992
N-[(1R)-1-(2-methoxyphenyl)ethyl]-4-methyl-2-pyridin-3-yl-1,3-thiazole-5-carboxamide
CID 28560675
N,4-dimethyl-2-pyridin-3-yl-1,3-thiazol-5-amine
CID 59580850
4-methyl-2-pyridin-3-yl-N-(1-pyrimidin-2-ylethyl)-1,3-thiazole-5-carboxamide
CID 58236230
4-methoxy-N-[1-(1,3-thiazol-4-yl)ethyl]pyridin-2-amine
CID 115922887
4-bromo-5-(3-methylbutan-2-yl)-2-pyridin-3-yl-1,3-thiazole
CID 160725077
N-(3,3-dimethylbutan-2-yl)-4-methoxypyridin-2-amine
CID 115922894
4-methoxy-N-[[2-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-6,7-dihydro-5H-quinolin-8-ylidene]amino]aniline
CID 123932684
(1S)-1-[2-(4-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]-N-[(5-methyl-1,3-oxazol-2-yl)methyl]ethanamine
CID 97353561

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[1-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)ethyl]pyridin-2-amine?
The IUPAC name of 4-methoxy-N-[1-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)ethyl]pyridin-2-amine (CID 75498025) is 4-methoxy-N-[1-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)ethyl]pyridin-2-amine.
What is the SMILES notation for 4-methoxy-N-[1-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)ethyl]pyridin-2-amine?
The canonical SMILES for 4-methoxy-N-[1-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)ethyl]pyridin-2-amine is COc1ccnc(NC(C)c2sc(-c3cccnc3)nc2C)c1.
What is the InChIKey of 4-methoxy-N-[1-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)ethyl]pyridin-2-amine?
The InChIKey is QKVIEWATRIOBRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4OS/c1-11(20-15-9-14(22-3)6-8-19-15)16-12(2)21-17(23-16)13-5-4-7-18-10-13/h4-11H,1-3H3,(H,19,20).
What are the key properties of 4-methoxy-N-[1-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)ethyl]pyridin-2-amine?
4-methoxy-N-[1-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)ethyl]pyridin-2-amine has a molecular weight of 326.43 g/mol, XLogP of 4.09, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[1-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)ethyl]pyridin-2-amine is sourced from PubChem (CID 75498025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).