1-[1-[(4-methoxy-7-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-2-yl)amino]ethenyl]-4-methylpiperidin-4-ol

C19H27N5O3S — CID 167215482

IUPAC1-[1-[(4-methoxy-7-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-2-yl)amino]ethenyl]-4-methylpiperidin-4-ol
SMILESC=C(Nc1nc2c(OC)ncc(N3CCOCC3)c2s1)N1CCC(C)(O)CC1
InChIInChI=1S/C19H27N5O3S/c1-13(23-6-4-19(2,25)5-7-23)21-18-22-15-16(28-18)14(12-20-17(15)26-3)24-8-10-27-11-9-24/h12,25H,1,4-11H2,2-3H3,(H,21,22)
InChIKeyWBPKYZBDNLEMKY-UHFFFAOYSA-N
MW405.52 g/mol
LogP2.27
Rot. Bonds5

About 1-[1-[(4-methoxy-7-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-2-yl)amino]ethenyl]-4-methylpiperidin-4-ol

1-[1-[(4-methoxy-7-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-2-yl)amino]ethenyl]-4-methylpiperidin-4-ol (PubChem CID 167215482) has the molecular formula C19H27N5O3S and a molecular weight of 405.52 g/mol. Its IUPAC name is 1-[1-[(4-methoxy-7-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-2-yl)amino]ethenyl]-4-methylpiperidin-4-ol.

Molecular Properties

Compound Name1-[1-[(4-methoxy-7-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-2-yl)amino]ethenyl]-4-methylpiperidin-4-ol
PubChem CID167215482
Molecular FormulaC19H27N5O3S
Molecular Weight405.52 g/mol
Exact Mass405.18
IUPAC Name1-[1-[(4-methoxy-7-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-2-yl)amino]ethenyl]-4-methylpiperidin-4-ol
SMILESC=C(Nc1nc2c(OC)ncc(N3CCOCC3)c2s1)N1CCC(C)(O)CC1
InChIInChI=1S/C19H27N5O3S/c1-13(23-6-4-19(2,25)5-7-23)21-18-22-15-16(28-18)14(12-20-17(15)26-3)24-8-10-27-11-9-24/h12,25H,1,4-11H2,2-3H3,(H,21,22)
InChIKeyWBPKYZBDNLEMKY-UHFFFAOYSA-N
XLogP2.27
TPSA82.98 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.52
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

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Related Compounds

N-(4-methoxy-7-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-7-oxa-2-azaspiro[4.5]decane-2-carboxamide
CID 142524461
4-hydroxy-N-(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)-4-methylpiperidine-1-carboxamide
CID 11618368
N-(4-methoxy-7-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-2-methyl-1,3-oxazole-5-carboxamide
CID 137462557
4-hydroxy-N-(4-methoxy-7-morpholin-4-yl-3H-imidazo[4,5-c]pyridin-2-yl)-4-methylpiperidine-1-carboxamide
CID 162657493
1-(2-methoxyethyl)-N-(4-methoxy-7-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-2-yl)pyrazole-4-carboxamide
CID 137474685
1-(2-methoxyethyl)-N-(4-methoxy-7-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-2-yl)pyrrole-3-carboxamide
CID 146653113
N-[7-(3-ethoxy-3-methylazetidin-1-yl)-4-methoxy-[1,3]thiazolo[4,5-c]pyridin-2-yl]-2-oxa-7-azaspiro[4.4]nonane-7-carboxamide
CID 142524382
4-hydroxy-N-(4-methoxy-7-phenyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-4-methylpiperidine-1-carboxamide
CID 142524362
(7-methoxy-4-morpholin-4-yl-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamic acid
CID 154342872
(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)urea
CID 22283121
N-[7-(furan-2-yl)-4-methoxy-[1,3]thiazolo[4,5-c]pyridin-2-yl]-8-oxa-2-azaspiro[4.5]decane-2-carboxamide
CID 164738669
N-(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)-2-methylpropanamide
CID 22283227

Frequently Asked Questions

What is the IUPAC name of 1-[1-[(4-methoxy-7-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-2-yl)amino]ethenyl]-4-methylpiperidin-4-ol?
The IUPAC name of 1-[1-[(4-methoxy-7-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-2-yl)amino]ethenyl]-4-methylpiperidin-4-ol (CID 167215482) is 1-[1-[(4-methoxy-7-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-2-yl)amino]ethenyl]-4-methylpiperidin-4-ol.
What is the SMILES notation for 1-[1-[(4-methoxy-7-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-2-yl)amino]ethenyl]-4-methylpiperidin-4-ol?
The canonical SMILES for 1-[1-[(4-methoxy-7-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-2-yl)amino]ethenyl]-4-methylpiperidin-4-ol is C=C(Nc1nc2c(OC)ncc(N3CCOCC3)c2s1)N1CCC(C)(O)CC1.
What is the InChIKey of 1-[1-[(4-methoxy-7-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-2-yl)amino]ethenyl]-4-methylpiperidin-4-ol?
The InChIKey is WBPKYZBDNLEMKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O3S/c1-13(23-6-4-19(2,25)5-7-23)21-18-22-15-16(28-18)14(12-20-17(15)26-3)24-8-10-27-11-9-24/h12,25H,1,4-11H2,2-3H3,(H,21,22).
What are the key properties of 1-[1-[(4-methoxy-7-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-2-yl)amino]ethenyl]-4-methylpiperidin-4-ol?
1-[1-[(4-methoxy-7-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-2-yl)amino]ethenyl]-4-methylpiperidin-4-ol has a molecular weight of 405.52 g/mol, XLogP of 2.27, 5 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(4-methoxy-7-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-2-yl)amino]ethenyl]-4-methylpiperidin-4-ol is sourced from PubChem (CID 167215482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).