2-(4,7-dihydro-1H-pyrazolo[5,4-b]pyridin-6-yl)-N-methylethanamine

C9H14N4 — CID 141082771

IUPAC2-(4,7-dihydro-1H-pyrazolo[5,4-b]pyridin-6-yl)-N-methylethanamine
SMILESCNCCC1=CCc2cn[nH]c2N1
InChIInChI=1S/C9H14N4/c1-10-5-4-8-3-2-7-6-11-13-9(7)12-8/h3,6,10H,2,4-5H2,1H3,(H2,11,12,13)
InChIKeyQLSUFQRAAAWYTJ-UHFFFAOYSA-N
MW178.24 g/mol
LogP0.87
Rot. Bonds3

About 2-(4,7-dihydro-1H-pyrazolo[5,4-b]pyridin-6-yl)-N-methylethanamine

2-(4,7-dihydro-1H-pyrazolo[5,4-b]pyridin-6-yl)-N-methylethanamine (PubChem CID 141082771) has the molecular formula C9H14N4 and a molecular weight of 178.24 g/mol. Its IUPAC name is 2-(4,7-dihydro-1H-pyrazolo[5,4-b]pyridin-6-yl)-N-methylethanamine.

Molecular Properties

Compound Name2-(4,7-dihydro-1H-pyrazolo[5,4-b]pyridin-6-yl)-N-methylethanamine
PubChem CID141082771
Molecular FormulaC9H14N4
Molecular Weight178.24 g/mol
Exact Mass178.12
IUPAC Name2-(4,7-dihydro-1H-pyrazolo[5,4-b]pyridin-6-yl)-N-methylethanamine
SMILESCNCCC1=CCc2cn[nH]c2N1
InChIInChI=1S/C9H14N4/c1-10-5-4-8-3-2-7-6-11-13-9(7)12-8/h3,6,10H,2,4-5H2,1H3,(H2,11,12,13)
InChIKeyQLSUFQRAAAWYTJ-UHFFFAOYSA-N
XLogP0.87
TPSA52.74 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 50.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

Pyrazolyltetra-hydroindazole
CID 129815114
4-tert-butyl-N-ethyl-1H-pyrazol-5-amine
CID 58477481
N-pentyl-4-prop-2-enyl-1H-pyrazol-5-amine
CID 67647527
N,4-diethyl-1H-pyrazol-5-amine
CID 68223083
4-ethyl-N-methyl-1H-pyrazol-5-amine
CID 68223090
N-(2-cyclohexa-1,3-dien-1-ylethyl)-4-methyl-1H-pyrazol-5-amine
CID 71277750
N-ethyl-4-propan-2-yl-1H-pyrazol-5-amine
CID 90734715
5-N-(2-cyclohexa-1,5-dien-1-ylethyl)-4-ethyl-3-N,3-N-dimethyl-1H-pyrazole-3,5-diamine
CID 123452941
4-[amino(1H-pyrazol-5-yl)amino]-1,2,3,6-tetrahydropyridin-5-amine
CID 129153187
2-methyl-4-N-(1H-pyrazol-5-yl)-1,2,3,6-tetrahydropyridine-4,5-diamine
CID 129153210
6-methyl-1-(1H-pyrazol-5-yl)-2,3,4,5,6,7-hexahydrotriazolo[4,5-c]pyridine
CID 132063069
4-[amino(1H-pyrazol-5-yl)amino]-2-methyl-1,2,3,6-tetrahydropyridin-5-amine
CID 134547255

Frequently Asked Questions

What is the IUPAC name of 2-(4,7-dihydro-1H-pyrazolo[5,4-b]pyridin-6-yl)-N-methylethanamine?
The IUPAC name of 2-(4,7-dihydro-1H-pyrazolo[5,4-b]pyridin-6-yl)-N-methylethanamine (CID 141082771) is 2-(4,7-dihydro-1H-pyrazolo[5,4-b]pyridin-6-yl)-N-methylethanamine.
What is the SMILES notation for 2-(4,7-dihydro-1H-pyrazolo[5,4-b]pyridin-6-yl)-N-methylethanamine?
The canonical SMILES for 2-(4,7-dihydro-1H-pyrazolo[5,4-b]pyridin-6-yl)-N-methylethanamine is CNCCC1=CCc2cn[nH]c2N1.
What is the InChIKey of 2-(4,7-dihydro-1H-pyrazolo[5,4-b]pyridin-6-yl)-N-methylethanamine?
The InChIKey is QLSUFQRAAAWYTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4/c1-10-5-4-8-3-2-7-6-11-13-9(7)12-8/h3,6,10H,2,4-5H2,1H3,(H2,11,12,13).
What are the key properties of 2-(4,7-dihydro-1H-pyrazolo[5,4-b]pyridin-6-yl)-N-methylethanamine?
2-(4,7-dihydro-1H-pyrazolo[5,4-b]pyridin-6-yl)-N-methylethanamine has a molecular weight of 178.24 g/mol, XLogP of 0.87, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,7-dihydro-1H-pyrazolo[5,4-b]pyridin-6-yl)-N-methylethanamine is sourced from PubChem (CID 141082771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).