[1-[(1-fluorocyclopropyl)methyl]pyrazolo[3,4-c]pyridin-5-yl]methanamine

C11H13FN4 — CID 165403253

IUPAC[1-[(1-fluorocyclopropyl)methyl]pyrazolo[3,4-c]pyridin-5-yl]methanamine
SMILESNCc1cc2cnn(CC3(F)CC3)c2cn1
InChIInChI=1S/C11H13FN4/c12-11(1-2-11)7-16-10-6-14-9(4-13)3-8(10)5-15-16/h3,5-6H,1-2,4,7,13H2
InChIKeyORORFGOVNHYQMQ-UHFFFAOYSA-N
MW220.25 g/mol
LogP1.39
Rot. Bonds3

About [1-[(1-fluorocyclopropyl)methyl]pyrazolo[3,4-c]pyridin-5-yl]methanamine

[1-[(1-fluorocyclopropyl)methyl]pyrazolo[3,4-c]pyridin-5-yl]methanamine (PubChem CID 165403253) has the molecular formula C11H13FN4 and a molecular weight of 220.25 g/mol. Its IUPAC name is [1-[(1-fluorocyclopropyl)methyl]pyrazolo[3,4-c]pyridin-5-yl]methanamine.

Molecular Properties

Compound Name[1-[(1-fluorocyclopropyl)methyl]pyrazolo[3,4-c]pyridin-5-yl]methanamine
PubChem CID165403253
Molecular FormulaC11H13FN4
Molecular Weight220.25 g/mol
Exact Mass220.11
IUPAC Name[1-[(1-fluorocyclopropyl)methyl]pyrazolo[3,4-c]pyridin-5-yl]methanamine
SMILESNCc1cc2cnn(CC3(F)CC3)c2cn1
InChIInChI=1S/C11H13FN4/c12-11(1-2-11)7-16-10-6-14-9(4-13)3-8(10)5-15-16/h3,5-6H,1-2,4,7,13H2
InChIKeyORORFGOVNHYQMQ-UHFFFAOYSA-N
XLogP1.39
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.25
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-Methyl-5-(Pyridin-3-Yl)-2h-Pyrazolo[3,4-C]pyridine
CID 71254055
3-[2-Fluoro-5-(trifluoromethyl)phenyl]-1-(pyrazin-2-ylmethyl)indazole
CID 73504556
3-[2-Fluoro-5-(trifluoromethyl)phenyl]-7-methyl-1-(pyrazin-2-ylmethyl)indazole
CID 73504557
7-Fluoro-3-[2-fluoro-5-(trifluoromethyl)phenyl]-1-(pyrazin-2-ylmethyl)indazole
CID 134611927
N-cyclohexyl-3-methyl-2H-pyrazolo[3,4-c]pyridin-4-amine
CID 54673065
3-phenyl-5-(pyridin-3-yl)-1H-pyrazolo[3,4-c]pyridine
CID 71253684
5-(1-methylpyrazol-4-yl)-3-pyridin-2-yl-1H-pyrazolo[3,4-c]pyridine
CID 71253921
3-methyl-5-(1H-pyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridine
CID 71512722
5-Fluoro-1-pyridin-3-ylindazole
CID 76286753
5-Fluoro-1-(5-fluoro-3-pyridinyl)indazole
CID 90252839
5-Fluoro-1-[5-(trifluoromethyl)pyridin-3-yl]indazole
CID 90252954
(2R)-1-(1-pyridin-4-yltriazol-4-yl)-3-(2,4,5-trifluorophenyl)propan-2-amine
CID 142737231

Frequently Asked Questions

What is the IUPAC name of [1-[(1-fluorocyclopropyl)methyl]pyrazolo[3,4-c]pyridin-5-yl]methanamine?
The IUPAC name of [1-[(1-fluorocyclopropyl)methyl]pyrazolo[3,4-c]pyridin-5-yl]methanamine (CID 165403253) is [1-[(1-fluorocyclopropyl)methyl]pyrazolo[3,4-c]pyridin-5-yl]methanamine.
What is the SMILES notation for [1-[(1-fluorocyclopropyl)methyl]pyrazolo[3,4-c]pyridin-5-yl]methanamine?
The canonical SMILES for [1-[(1-fluorocyclopropyl)methyl]pyrazolo[3,4-c]pyridin-5-yl]methanamine is NCc1cc2cnn(CC3(F)CC3)c2cn1.
What is the InChIKey of [1-[(1-fluorocyclopropyl)methyl]pyrazolo[3,4-c]pyridin-5-yl]methanamine?
The InChIKey is ORORFGOVNHYQMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN4/c12-11(1-2-11)7-16-10-6-14-9(4-13)3-8(10)5-15-16/h3,5-6H,1-2,4,7,13H2.
What are the key properties of [1-[(1-fluorocyclopropyl)methyl]pyrazolo[3,4-c]pyridin-5-yl]methanamine?
[1-[(1-fluorocyclopropyl)methyl]pyrazolo[3,4-c]pyridin-5-yl]methanamine has a molecular weight of 220.25 g/mol, XLogP of 1.39, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(1-fluorocyclopropyl)methyl]pyrazolo[3,4-c]pyridin-5-yl]methanamine is sourced from PubChem (CID 165403253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).