3-azabicyclo[3.1.0]hexane;N-methyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-amine

C17H22N6 — CID 163302197

IUPAC3-azabicyclo[3.1.0]hexane;N-methyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-amine
SMILESC1NCC2CC12.CNc1cc(-c2cnn(C)c2)cn2nccc12
InChIInChI=1S/C12H13N5.C5H9N/c1-13-11-5-9(10-6-15-16(2)7-10)8-17-12(11)3-4-14-17;1-4-2-6-3-5(1)4/h3-8,13H,1-2H3;4-6H,1-3H2
InChIKeyZOQUIBWXNKNKTI-UHFFFAOYSA-N
MW310.41 g/mol
LogP2.00
Rot. Bonds2

About 3-azabicyclo[3.1.0]hexane;N-methyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-amine

3-azabicyclo[3.1.0]hexane;N-methyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-amine (PubChem CID 163302197) has the molecular formula C17H22N6 and a molecular weight of 310.41 g/mol. Its IUPAC name is 3-azabicyclo[3.1.0]hexane;N-methyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-amine.

Molecular Properties

Compound Name3-azabicyclo[3.1.0]hexane;N-methyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-amine
PubChem CID163302197
Molecular FormulaC17H22N6
Molecular Weight310.41 g/mol
Exact Mass310.19
IUPAC Name3-azabicyclo[3.1.0]hexane;N-methyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-amine
SMILESC1NCC2CC12.CNc1cc(-c2cnn(C)c2)cn2nccc12
InChIInChI=1S/C12H13N5.C5H9N/c1-13-11-5-9(10-6-15-16(2)7-10)8-17-12(11)3-4-14-17;1-4-2-6-3-5(1)4/h3-8,13H,1-2H3;4-6H,1-3H2
InChIKeyZOQUIBWXNKNKTI-UHFFFAOYSA-N
XLogP2.00
TPSA59.18 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.41
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-(1-methylpyrazol-4-yl)-4-(1,2,3,6-tetrahydropyridin-4-yl)pyrazolo[1,5-a]pyridine
CID 168886506
1-[(1S,5R)-6-[[[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]amino]methyl]-3-azabicyclo[3.1.0]hexan-3-yl]prop-2-en-1-one
CID 167070882
(3R)-1-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]pyrrolidin-3-amine
CID 175735098
(3S)-1-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]pyrrolidin-3-amine
CID 175735086
N-methyl-3-(1-methylpyrazol-4-yl)aniline
CID 106505763
4-(3-azabicyclo[3.1.1]heptan-6-ylmethoxy)-3-fluoro-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine
CID 163301882
2-N-methoxy-1-N-methyl-4-(1-methylpyrazol-4-yl)benzene-1,2-diamine
CID 166844202
3-iodo-4-methoxy-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine;4-methoxy-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine
CID 159218471
3-[(1R,5R)-3-[6-(1-methylpyrazol-4-yl)pyrrolo[1,2-b]pyridazin-4-yl]-3,8-diazabicyclo[3.2.1]octan-8-yl]cyclobutan-1-ol
CID 176888374
tert-butyl azepane-1-carboxylate;6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-ol
CID 163302303
cis-(1S,3R)-N-methyl-3-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-4-yl]cyclohexan-1-amine;hydrochloride
CID 172552286
(3S,5R)-N-methyl-5-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-4-yl]oxyoxan-3-amine
CID 167070776

Frequently Asked Questions

What is the IUPAC name of 3-azabicyclo[3.1.0]hexane;N-methyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-amine?
The IUPAC name of 3-azabicyclo[3.1.0]hexane;N-methyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-amine (CID 163302197) is 3-azabicyclo[3.1.0]hexane;N-methyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-amine.
What is the SMILES notation for 3-azabicyclo[3.1.0]hexane;N-methyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-amine?
The canonical SMILES for 3-azabicyclo[3.1.0]hexane;N-methyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-amine is C1NCC2CC12.CNc1cc(-c2cnn(C)c2)cn2nccc12.
What is the InChIKey of 3-azabicyclo[3.1.0]hexane;N-methyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-amine?
The InChIKey is ZOQUIBWXNKNKTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N5.C5H9N/c1-13-11-5-9(10-6-15-16(2)7-10)8-17-12(11)3-4-14-17;1-4-2-6-3-5(1)4/h3-8,13H,1-2H3;4-6H,1-3H2.
What are the key properties of 3-azabicyclo[3.1.0]hexane;N-methyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-amine?
3-azabicyclo[3.1.0]hexane;N-methyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-amine has a molecular weight of 310.41 g/mol, XLogP of 2.00, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-azabicyclo[3.1.0]hexane;N-methyl-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-amine is sourced from PubChem (CID 163302197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).