N-(5H-pyrrolo[3,4-b]pyridin-7-yl)-1,3-thiazol-2-amine

C10H8N4S — CID 159505211

IUPACN-(5H-pyrrolo[3,4-b]pyridin-7-yl)-1,3-thiazol-2-amine
SMILESc1cnc2c(c1)CN=C2Nc1nccs1
InChIInChI=1S/C10H8N4S/c1-2-7-6-13-9(8(7)11-3-1)14-10-12-4-5-15-10/h1-5H,6H2,(H,12,13,14)
InChIKeyREFOVCPLXRFDAR-UHFFFAOYSA-N
MW216.27 g/mol
LogP1.91
Rot. Bonds1

About N-(5H-pyrrolo[3,4-b]pyridin-7-yl)-1,3-thiazol-2-amine

N-(5H-pyrrolo[3,4-b]pyridin-7-yl)-1,3-thiazol-2-amine (PubChem CID 159505211) has the molecular formula C10H8N4S and a molecular weight of 216.27 g/mol. Its IUPAC name is N-(5H-pyrrolo[3,4-b]pyridin-7-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(5H-pyrrolo[3,4-b]pyridin-7-yl)-1,3-thiazol-2-amine
PubChem CID159505211
Molecular FormulaC10H8N4S
Molecular Weight216.27 g/mol
Exact Mass216.05
IUPAC NameN-(5H-pyrrolo[3,4-b]pyridin-7-yl)-1,3-thiazol-2-amine
SMILESc1cnc2c(c1)CN=C2Nc1nccs1
InChIInChI=1S/C10H8N4S/c1-2-7-6-13-9(8(7)11-3-1)14-10-12-4-5-15-10/h1-5H,6H2,(H,12,13,14)
InChIKeyREFOVCPLXRFDAR-UHFFFAOYSA-N
XLogP1.91
TPSA50.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.27
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(6-methyl-2-pyridinyl)-5H-pyrrolo[3,4-b]pyridin-7-amine
CID 158159052
1-N-pyrimidin-2-yl-2-N-(1,3-thiazol-2-yl)benzene-1,2-diamine
CID 123214519
N-(2-fluorophenyl)-1,3-thiazol-2-amine
CID 82537266
N-(4-tert-butylphenyl)-1,3-thiazol-2-amine
CID 89458948
1,1-dioxo-N-(1,3-thiazol-2-yl)-1,2-benzothiazol-3-amine
CID 4770387
N-(4-fluoronaphthalen-1-yl)-1,3-thiazol-2-amine
CID 91534267
1-methyl-3-(3-methylphenyl)-N-(5H-pyrrolo[3,4-b]pyridin-7-yl)indazol-6-amine
CID 161320320
1-N-(cyclopentylmethyl)-6-N-(5H-pyrrolo[3,4-b]pyridin-7-yl)isoquinoline-1,6-diamine
CID 158219698
(7S)-N-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]bicyclo[4.2.0]octa-1,3,5-triene-7-carboxamide
CID 95981281
1-[4-[6-(5H-pyrrolo[3,4-b]pyridin-7-ylamino)naphthalene-1-carbonyl]piperazin-1-yl]ethanone
CID 161424529
N-(3-cyclopropylphenyl)-1,3-thiazol-2-amine
CID 174465253
2-amino-N-(1,3-thiazol-2-yl)pyridine-3-sulfonamide
CID 62148610

Frequently Asked Questions

What is the IUPAC name of N-(5H-pyrrolo[3,4-b]pyridin-7-yl)-1,3-thiazol-2-amine?
The IUPAC name of N-(5H-pyrrolo[3,4-b]pyridin-7-yl)-1,3-thiazol-2-amine (CID 159505211) is N-(5H-pyrrolo[3,4-b]pyridin-7-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-(5H-pyrrolo[3,4-b]pyridin-7-yl)-1,3-thiazol-2-amine?
The canonical SMILES for N-(5H-pyrrolo[3,4-b]pyridin-7-yl)-1,3-thiazol-2-amine is c1cnc2c(c1)CN=C2Nc1nccs1.
What is the InChIKey of N-(5H-pyrrolo[3,4-b]pyridin-7-yl)-1,3-thiazol-2-amine?
The InChIKey is REFOVCPLXRFDAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N4S/c1-2-7-6-13-9(8(7)11-3-1)14-10-12-4-5-15-10/h1-5H,6H2,(H,12,13,14).
What are the key properties of N-(5H-pyrrolo[3,4-b]pyridin-7-yl)-1,3-thiazol-2-amine?
N-(5H-pyrrolo[3,4-b]pyridin-7-yl)-1,3-thiazol-2-amine has a molecular weight of 216.27 g/mol, XLogP of 1.91, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5H-pyrrolo[3,4-b]pyridin-7-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 159505211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).