2-N-[(1,5-dimethylpyrazol-4-yl)methyl]pyrazine-2,5-diamine

C10H14N6 — CID 106040838

IUPAC2-N-[(1,5-dimethylpyrazol-4-yl)methyl]pyrazine-2,5-diamine
SMILESCc1c(CNc2cnc(N)cn2)cnn1C
InChIInChI=1S/C10H14N6/c1-7-8(4-15-16(7)2)3-13-10-6-12-9(11)5-14-10/h4-6H,3H2,1-2H3,(H2,11,12)(H,13,14)
InChIKeyDOKQXDIXBYEVTE-UHFFFAOYSA-N
MW218.26 g/mol
LogP0.71
Rot. Bonds3

About 2-N-[(1,5-dimethylpyrazol-4-yl)methyl]pyrazine-2,5-diamine

2-N-[(1,5-dimethylpyrazol-4-yl)methyl]pyrazine-2,5-diamine (PubChem CID 106040838) has the molecular formula C10H14N6 and a molecular weight of 218.26 g/mol. Its IUPAC name is 2-N-[(1,5-dimethylpyrazol-4-yl)methyl]pyrazine-2,5-diamine.

Molecular Properties

Compound Name2-N-[(1,5-dimethylpyrazol-4-yl)methyl]pyrazine-2,5-diamine
PubChem CID106040838
Molecular FormulaC10H14N6
Molecular Weight218.26 g/mol
Exact Mass218.13
IUPAC Name2-N-[(1,5-dimethylpyrazol-4-yl)methyl]pyrazine-2,5-diamine
SMILESCc1c(CNc2cnc(N)cn2)cnn1C
InChIInChI=1S/C10H14N6/c1-7-8(4-15-16(7)2)3-13-10-6-12-9(11)5-14-10/h4-6H,3H2,1-2H3,(H2,11,12)(H,13,14)
InChIKeyDOKQXDIXBYEVTE-UHFFFAOYSA-N
XLogP0.71
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-N-[(1,5-dimethylpyrazol-4-yl)methyl]pyrimidine-2,4,6-triamine
CID 114139819
6-N-[(1,5-dimethylpyrazol-4-yl)methyl]pyridine-2,3,6-triamine
CID 106035379
4-N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-propylpyrimidine-4,6-diamine
CID 106041164
6-N-[(1,5-dimethylpyrazol-4-yl)methyl]-4-(trifluoromethyl)pyridine-2,6-diamine
CID 106041353
4-N-[(1,5-dimethylpyrazol-4-yl)methyl]-6-N-methylpyrimidine-4,6-diamine
CID 114139841
N-[(1,5-dimethylpyrazol-4-yl)methyl]-6-hydrazinylpyrazin-2-amine
CID 106043318
N-[(1,5-dimethylpyrazol-4-yl)methyl]-4-methylaniline
CID 19619046
4-N-[(1,5-dimethylpyrazol-4-yl)methyl]pyrimidine-4,5-diamine
CID 106035329
2-N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]pyrazine-2,5-diamine
CID 112672189
N-[(1,5-dimethylpyrazol-4-yl)methyl]-6-ethylpyrimidin-4-amine
CID 113340081
4-bromo-N-[(1,5-dimethylpyrazol-4-yl)methyl]aniline
CID 79578438
N-[(1,5-dimethylpyrazol-4-yl)methyl]-4-fluoroaniline
CID 19619060

Frequently Asked Questions

What is the IUPAC name of 2-N-[(1,5-dimethylpyrazol-4-yl)methyl]pyrazine-2,5-diamine?
The IUPAC name of 2-N-[(1,5-dimethylpyrazol-4-yl)methyl]pyrazine-2,5-diamine (CID 106040838) is 2-N-[(1,5-dimethylpyrazol-4-yl)methyl]pyrazine-2,5-diamine.
What is the SMILES notation for 2-N-[(1,5-dimethylpyrazol-4-yl)methyl]pyrazine-2,5-diamine?
The canonical SMILES for 2-N-[(1,5-dimethylpyrazol-4-yl)methyl]pyrazine-2,5-diamine is Cc1c(CNc2cnc(N)cn2)cnn1C.
What is the InChIKey of 2-N-[(1,5-dimethylpyrazol-4-yl)methyl]pyrazine-2,5-diamine?
The InChIKey is DOKQXDIXBYEVTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6/c1-7-8(4-15-16(7)2)3-13-10-6-12-9(11)5-14-10/h4-6H,3H2,1-2H3,(H2,11,12)(H,13,14).
What are the key properties of 2-N-[(1,5-dimethylpyrazol-4-yl)methyl]pyrazine-2,5-diamine?
2-N-[(1,5-dimethylpyrazol-4-yl)methyl]pyrazine-2,5-diamine has a molecular weight of 218.26 g/mol, XLogP of 0.71, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[(1,5-dimethylpyrazol-4-yl)methyl]pyrazine-2,5-diamine is sourced from PubChem (CID 106040838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).