N,5-dimethyl-3-([1,3]thiazolo[4,5-c]pyridin-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-amine

C15H16N4S2 — CID 145201697

IUPACN,5-dimethyl-3-([1,3]thiazolo[4,5-c]pyridin-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-amine
SMILESCNc1sc2c(c1-c1nc3cnccc3s1)CC(C)NC2
InChIInChI=1S/C15H16N4S2/c1-8-5-9-12(7-18-8)21-14(16-2)13(9)15-19-10-6-17-4-3-11(10)20-15/h3-4,6,8,16,18H,5,7H2,1-2H3
InChIKeyMEDLRTLESRCLGP-UHFFFAOYSA-N
MW316.46 g/mol
LogP3.50
Rot. Bonds2

About N,5-dimethyl-3-([1,3]thiazolo[4,5-c]pyridin-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-amine

N,5-dimethyl-3-([1,3]thiazolo[4,5-c]pyridin-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-amine (PubChem CID 145201697) has the molecular formula C15H16N4S2 and a molecular weight of 316.46 g/mol. Its IUPAC name is N,5-dimethyl-3-([1,3]thiazolo[4,5-c]pyridin-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-amine.

Molecular Properties

Compound NameN,5-dimethyl-3-([1,3]thiazolo[4,5-c]pyridin-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-amine
PubChem CID145201697
Molecular FormulaC15H16N4S2
Molecular Weight316.46 g/mol
Exact Mass316.08
IUPAC NameN,5-dimethyl-3-([1,3]thiazolo[4,5-c]pyridin-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-amine
SMILESCNc1sc2c(c1-c1nc3cnccc3s1)CC(C)NC2
InChIInChI=1S/C15H16N4S2/c1-8-5-9-12(7-18-8)21-14(16-2)13(9)15-19-10-6-17-4-3-11(10)20-15/h3-4,6,8,16,18H,5,7H2,1-2H3
InChIKeyMEDLRTLESRCLGP-UHFFFAOYSA-N
XLogP3.50
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.46
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-(2-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl)-[1,3]thiazolo[4,5-c]pyridine
CID 145201793
3-(azetidin-3-ylamino)-N-[3-([1,3]thiazolo[4,5-c]pyridin-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl]propanamide;ethane
CID 145201797
tert-butyl (5R)-2-acetamido-5,7-dimethyl-3-([1,3]thiazolo[4,5-c]pyridin-2-yl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate
CID 145201751
3-(2,2-dioxo-2λ6-thia-6-azaspiro[3.3]heptan-6-yl)-N-[3-([1,3]thiazolo[4,5-c]pyridin-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl]propanamide;molecular hydrogen
CID 159648913
acetaldehyde;N,5-dimethyl-3-([1,3]thiazolo[4,5-c]pyridin-2-yl)thiophen-2-amine
CID 145201737
tert-butyl (5R)-2-[3-[[(3aR,6aS)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-5-yl]amino]propanoylamino]-5-methyl-3-([1,3]thiazolo[4,5-c]pyridin-2-yl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate
CID 175944190
1-[3-(1,3-benzothiazol-2-yl)-5-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl]-7-methoxyheptan-2-one
CID 158151693
molecular hydrogen;3-(1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-yl)-N-[3-([1,3]thiazolo[4,5-c]pyridin-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl]propanamide
CID 158931200
7-methoxy-1-[5-methyl-3-(5-pyridin-4-yl-1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]heptan-2-one;7-methoxy-1-[7-methyl-3-(5-pyridin-4-yl-1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]heptan-2-one;7-methoxy-1-[5-methyl-3-(5-pyridin-4-yl-1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl]heptan-2-one
CID 161162876
2-N-(cyclopropylmethyl)-6-methyl-4-N-(3-methylpentyl)-5-([1,3]thiazolo[4,5-c]pyridin-2-yl)pyrimidine-2,4-diamine
CID 143945395
ethane;6-ethyl-3-([1,3]thiazolo[4,5-c]pyridin-2-yl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine
CID 145201710
6-(3-methylimidazol-4-yl)-1-[3-([1,3]thiazolo[4,5-c]pyridin-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl]hexan-2-one
CID 158657365

Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-3-([1,3]thiazolo[4,5-c]pyridin-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-amine?
The IUPAC name of N,5-dimethyl-3-([1,3]thiazolo[4,5-c]pyridin-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-amine (CID 145201697) is N,5-dimethyl-3-([1,3]thiazolo[4,5-c]pyridin-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-amine.
What is the SMILES notation for N,5-dimethyl-3-([1,3]thiazolo[4,5-c]pyridin-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-amine?
The canonical SMILES for N,5-dimethyl-3-([1,3]thiazolo[4,5-c]pyridin-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-amine is CNc1sc2c(c1-c1nc3cnccc3s1)CC(C)NC2.
What is the InChIKey of N,5-dimethyl-3-([1,3]thiazolo[4,5-c]pyridin-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-amine?
The InChIKey is MEDLRTLESRCLGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4S2/c1-8-5-9-12(7-18-8)21-14(16-2)13(9)15-19-10-6-17-4-3-11(10)20-15/h3-4,6,8,16,18H,5,7H2,1-2H3.
What are the key properties of N,5-dimethyl-3-([1,3]thiazolo[4,5-c]pyridin-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-amine?
N,5-dimethyl-3-([1,3]thiazolo[4,5-c]pyridin-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-amine has a molecular weight of 316.46 g/mol, XLogP of 3.50, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-3-([1,3]thiazolo[4,5-c]pyridin-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-amine is sourced from PubChem (CID 145201697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).