N-[3-(oxolan-2-ylmethoxy)-5-pyridin-2-yloxy-2-pyridinyl]-1,3-thiazol-2-amine

C18H18N4O3S — CID 59453442

IUPACN-[3-(oxolan-2-ylmethoxy)-5-pyridin-2-yloxy-2-pyridinyl]-1,3-thiazol-2-amine
SMILESc1ccc(Oc2cnc(Nc3nccs3)c(OCC3CCCO3)c2)nc1
InChIInChI=1S/C18H18N4O3S/c1-2-6-19-16(5-1)25-14-10-15(24-12-13-4-3-8-23-13)17(21-11-14)22-18-20-7-9-26-18/h1-2,5-7,9-11,13H,3-4,8,12H2,(H,20,21,22)
InChIKeyGRXMDXIGKALBSL-UHFFFAOYSA-N
MW370.43 g/mol
LogP4.03
Rot. Bonds7

About N-[3-(oxolan-2-ylmethoxy)-5-pyridin-2-yloxy-2-pyridinyl]-1,3-thiazol-2-amine

N-[3-(oxolan-2-ylmethoxy)-5-pyridin-2-yloxy-2-pyridinyl]-1,3-thiazol-2-amine (PubChem CID 59453442) has the molecular formula C18H18N4O3S and a molecular weight of 370.43 g/mol. Its IUPAC name is N-[3-(oxolan-2-ylmethoxy)-5-pyridin-2-yloxy-2-pyridinyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-[3-(oxolan-2-ylmethoxy)-5-pyridin-2-yloxy-2-pyridinyl]-1,3-thiazol-2-amine
PubChem CID59453442
Molecular FormulaC18H18N4O3S
Molecular Weight370.43 g/mol
Exact Mass370.11
IUPAC NameN-[3-(oxolan-2-ylmethoxy)-5-pyridin-2-yloxy-2-pyridinyl]-1,3-thiazol-2-amine
SMILESc1ccc(Oc2cnc(Nc3nccs3)c(OCC3CCCO3)c2)nc1
InChIInChI=1S/C18H18N4O3S/c1-2-6-19-16(5-1)25-14-10-15(24-12-13-4-3-8-23-13)17(21-11-14)22-18-20-7-9-26-18/h1-2,5-7,9-11,13H,3-4,8,12H2,(H,20,21,22)
InChIKeyGRXMDXIGKALBSL-UHFFFAOYSA-N
XLogP4.03
TPSA78.39 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.43
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze N-[3-(oxolan-2-ylmethoxy)-5-pyridin-2-yloxy-2-pyridinyl]-1,3-thiazol-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-[5-(4-methylsulfonylphenoxy)-3-(oxan-2-ylmethoxy)-2-pyridinyl]-1,3-thiazol-2-amine
CID 59453428
2-[[3-(oxolan-2-ylmethoxy)-5-pyridin-3-yloxy-2-pyridinyl]methyl]-1,3-thiazole
CID 159839065
1-[[4-[[(2R)-oxolan-2-yl]methoxy]phenyl]methyl]-3-(1,3-thiazol-2-yl)urea
CID 94025132
4-[[(2S)-oxolan-2-yl]methoxy]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]benzamide
CID 2161674
2-[(1R)-7-(3-fluorophenoxy)-1-methyl-6-(oxolan-2-ylmethoxy)-3,4-dihydro-2H-isoquinolin-1-yl]-1-(1,3-thiazol-2-ylamino)ethanol
CID 134372605
[2-(oxolan-2-ylmethoxy)phenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone
CID 42937228
1-benzyl-1-[[(2S)-oxolan-2-yl]methyl]-3-(1,3-thiazol-2-yl)urea
CID 94503654
N-(oxolan-2-ylmethyl)-2-(4-pyridin-2-yl-1,3-thiazol-2-yl)ethanamine
CID 82103423
1-[3-(oxolan-2-ylmethoxy)propyl]-3-(1,3-thiazol-2-yl)urea
CID 47148470
2-[(2-pyridin-2-yloxyphenoxy)methyl]morpholine
CID 12919862
1-[2-(oxolan-2-ylmethoxy)phenyl]-N-(thiophen-2-ylmethyl)methanamine
CID 54849898
2-(oxolan-2-ylmethoxy)-N-[(4-pyridin-2-yl-1,3-thiazol-2-yl)methyl]propanamide
CID 126837098

Frequently Asked Questions

What is the IUPAC name of N-[3-(oxolan-2-ylmethoxy)-5-pyridin-2-yloxy-2-pyridinyl]-1,3-thiazol-2-amine?
The IUPAC name of N-[3-(oxolan-2-ylmethoxy)-5-pyridin-2-yloxy-2-pyridinyl]-1,3-thiazol-2-amine (CID 59453442) is N-[3-(oxolan-2-ylmethoxy)-5-pyridin-2-yloxy-2-pyridinyl]-1,3-thiazol-2-amine.
What is the SMILES notation for N-[3-(oxolan-2-ylmethoxy)-5-pyridin-2-yloxy-2-pyridinyl]-1,3-thiazol-2-amine?
The canonical SMILES for N-[3-(oxolan-2-ylmethoxy)-5-pyridin-2-yloxy-2-pyridinyl]-1,3-thiazol-2-amine is c1ccc(Oc2cnc(Nc3nccs3)c(OCC3CCCO3)c2)nc1.
What is the InChIKey of N-[3-(oxolan-2-ylmethoxy)-5-pyridin-2-yloxy-2-pyridinyl]-1,3-thiazol-2-amine?
The InChIKey is GRXMDXIGKALBSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O3S/c1-2-6-19-16(5-1)25-14-10-15(24-12-13-4-3-8-23-13)17(21-11-14)22-18-20-7-9-26-18/h1-2,5-7,9-11,13H,3-4,8,12H2,(H,20,21,22).
What are the key properties of N-[3-(oxolan-2-ylmethoxy)-5-pyridin-2-yloxy-2-pyridinyl]-1,3-thiazol-2-amine?
N-[3-(oxolan-2-ylmethoxy)-5-pyridin-2-yloxy-2-pyridinyl]-1,3-thiazol-2-amine has a molecular weight of 370.43 g/mol, XLogP of 4.03, 7 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(oxolan-2-ylmethoxy)-5-pyridin-2-yloxy-2-pyridinyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 59453442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).