4-[4-(aminomethyl)pyrazol-1-yl]pyridine-2-carbonitrile

C10H9N5 — CID 82505920

IUPAC4-[4-(aminomethyl)pyrazol-1-yl]pyridine-2-carbonitrile
SMILESN#Cc1cc(-n2cc(CN)cn2)ccn1
InChIInChI=1S/C10H9N5/c11-4-8-6-14-15(7-8)10-1-2-13-9(3-10)5-12/h1-3,6-7H,4,11H2
InChIKeyOXQKNQYVABQJQE-UHFFFAOYSA-N
MW199.22 g/mol
LogP0.60
Rot. Bonds2

About 4-[4-(aminomethyl)pyrazol-1-yl]pyridine-2-carbonitrile

4-[4-(aminomethyl)pyrazol-1-yl]pyridine-2-carbonitrile (PubChem CID 82505920) has the molecular formula C10H9N5 and a molecular weight of 199.22 g/mol. Its IUPAC name is 4-[4-(aminomethyl)pyrazol-1-yl]pyridine-2-carbonitrile.

Molecular Properties

Compound Name4-[4-(aminomethyl)pyrazol-1-yl]pyridine-2-carbonitrile
PubChem CID82505920
Molecular FormulaC10H9N5
Molecular Weight199.22 g/mol
Exact Mass199.09
IUPAC Name4-[4-(aminomethyl)pyrazol-1-yl]pyridine-2-carbonitrile
SMILESN#Cc1cc(-n2cc(CN)cn2)ccn1
InChIInChI=1S/C10H9N5/c11-4-8-6-14-15(7-8)10-1-2-13-9(3-10)5-12/h1-3,6-7H,4,11H2
InChIKeyOXQKNQYVABQJQE-UHFFFAOYSA-N
XLogP0.60
TPSA80.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.22
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(1-pyridin-4-ylpyrazol-4-yl)methanamine
CID 20983373
4-[[2-(aminomethyl)pyrrol-1-yl]methyl]pyridine-2-carbonitrile
CID 66409699
[2-(4-ethylpyrazol-1-yl)-4-pyridinyl]methanamine
CID 84776884
[1-(4-chloropyrimidin-2-yl)pyrazol-4-yl]methanamine
CID 84780964
4-(1-oxo-1,4-thiazinan-4-yl)pyridine-2-carbonitrile
CID 55211755
4-[3-[(4-bromopyrazol-1-yl)methyl]azetidin-1-yl]pyridine-2-carbonitrile
CID 154580684
4-[[2-(aminomethyl)phenoxy]methyl]pyridine-2-carbonitrile
CID 63887638
4-[[4-(aminomethyl)-2,6-dibromophenoxy]methyl]pyridine-2-carbonitrile
CID 107741577
4-[[3-(aminomethyl)phenoxy]methyl]pyridine-2-carbonitrile
CID 63887840
4-[2-(1-methylpyrazol-4-yl)ethylamino]pyridine-2-carbonitrile
CID 80681842
4-piperazin-1-ylpyridine-2-carbonitrile;dihydrochloride
CID 154825612
[1-(3-chloro-2-pyridinyl)pyrazol-4-yl]methanamine
CID 82507728

Frequently Asked Questions

What is the IUPAC name of 4-[4-(aminomethyl)pyrazol-1-yl]pyridine-2-carbonitrile?
The IUPAC name of 4-[4-(aminomethyl)pyrazol-1-yl]pyridine-2-carbonitrile (CID 82505920) is 4-[4-(aminomethyl)pyrazol-1-yl]pyridine-2-carbonitrile.
What is the SMILES notation for 4-[4-(aminomethyl)pyrazol-1-yl]pyridine-2-carbonitrile?
The canonical SMILES for 4-[4-(aminomethyl)pyrazol-1-yl]pyridine-2-carbonitrile is N#Cc1cc(-n2cc(CN)cn2)ccn1.
What is the InChIKey of 4-[4-(aminomethyl)pyrazol-1-yl]pyridine-2-carbonitrile?
The InChIKey is OXQKNQYVABQJQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N5/c11-4-8-6-14-15(7-8)10-1-2-13-9(3-10)5-12/h1-3,6-7H,4,11H2.
What are the key properties of 4-[4-(aminomethyl)pyrazol-1-yl]pyridine-2-carbonitrile?
4-[4-(aminomethyl)pyrazol-1-yl]pyridine-2-carbonitrile has a molecular weight of 199.22 g/mol, XLogP of 0.60, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(aminomethyl)pyrazol-1-yl]pyridine-2-carbonitrile is sourced from PubChem (CID 82505920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).