3-N-(1H-pyrazol-4-ylmethyl)pyrazine-2,3-diamine

C8H10N6 — CID 102983865

IUPAC3-N-(1H-pyrazol-4-ylmethyl)pyrazine-2,3-diamine
SMILESNc1nccnc1NCc1cn[nH]c1
InChIInChI=1S/C8H10N6/c9-7-8(11-2-1-10-7)12-3-6-4-13-14-5-6/h1-2,4-5H,3H2,(H2,9,10)(H,11,12)(H,13,14)
InChIKeyPJLCCHVDASPBGX-UHFFFAOYSA-N
MW190.21 g/mol
LogP0.39
Rot. Bonds3

About 3-N-(1H-pyrazol-4-ylmethyl)pyrazine-2,3-diamine

3-N-(1H-pyrazol-4-ylmethyl)pyrazine-2,3-diamine (PubChem CID 102983865) has the molecular formula C8H10N6 and a molecular weight of 190.21 g/mol. Its IUPAC name is 3-N-(1H-pyrazol-4-ylmethyl)pyrazine-2,3-diamine.

Molecular Properties

Compound Name3-N-(1H-pyrazol-4-ylmethyl)pyrazine-2,3-diamine
PubChem CID102983865
Molecular FormulaC8H10N6
Molecular Weight190.21 g/mol
Exact Mass190.10
IUPAC Name3-N-(1H-pyrazol-4-ylmethyl)pyrazine-2,3-diamine
SMILESNc1nccnc1NCc1cn[nH]c1
InChIInChI=1S/C8H10N6/c9-7-8(11-2-1-10-7)12-3-6-4-13-14-5-6/h1-2,4-5H,3H2,(H2,9,10)(H,11,12)(H,13,14)
InChIKeyPJLCCHVDASPBGX-UHFFFAOYSA-N
XLogP0.39
TPSA92.51 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.21
LogP ≤ 50.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

3-chloro-N-(1H-pyrazol-4-ylmethyl)pyrazin-2-amine
CID 106193468
4-N-(1H-pyrazol-4-ylmethyl)pyrimidine-4,5-diamine
CID 79918333
N-(1H-pyrazol-4-ylmethyl)pyrimidin-2-amine
CID 61000619
3-N-[(4-ethylphenyl)methyl]pyrazine-2,3-diamine
CID 103634007
2,6-dimethyl-4-N-(1H-pyrazol-4-ylmethyl)pyrimidine-4,5-diamine
CID 146843134
1-(1H-pyrazol-4-ylmethylamino)isoquinolin-7-ol
CID 106537754
4-[[(3-aminopyrazin-2-yl)amino]methyl]benzonitrile
CID 113228938
3-N-[[3-(methoxymethyl)phenyl]methyl]pyrazine-2,3-diamine
CID 113228936
2-propan-2-yl-N-(1H-pyrazol-4-ylmethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104730829
N-(1H-pyrazol-4-ylmethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104730831
4-methyl-N-(1H-pyrazol-4-ylmethyl)pyrimidin-2-amine
CID 62958563
N-methyl-1-(1H-pyrazol-4-yl)methanamine
CID 22929644

Frequently Asked Questions

What is the IUPAC name of 3-N-(1H-pyrazol-4-ylmethyl)pyrazine-2,3-diamine?
The IUPAC name of 3-N-(1H-pyrazol-4-ylmethyl)pyrazine-2,3-diamine (CID 102983865) is 3-N-(1H-pyrazol-4-ylmethyl)pyrazine-2,3-diamine.
What is the SMILES notation for 3-N-(1H-pyrazol-4-ylmethyl)pyrazine-2,3-diamine?
The canonical SMILES for 3-N-(1H-pyrazol-4-ylmethyl)pyrazine-2,3-diamine is Nc1nccnc1NCc1cn[nH]c1.
What is the InChIKey of 3-N-(1H-pyrazol-4-ylmethyl)pyrazine-2,3-diamine?
The InChIKey is PJLCCHVDASPBGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N6/c9-7-8(11-2-1-10-7)12-3-6-4-13-14-5-6/h1-2,4-5H,3H2,(H2,9,10)(H,11,12)(H,13,14).
What are the key properties of 3-N-(1H-pyrazol-4-ylmethyl)pyrazine-2,3-diamine?
3-N-(1H-pyrazol-4-ylmethyl)pyrazine-2,3-diamine has a molecular weight of 190.21 g/mol, XLogP of 0.39, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(1H-pyrazol-4-ylmethyl)pyrazine-2,3-diamine is sourced from PubChem (CID 102983865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).