1-(2-aminoprop-2-enyl)pyrazole-4,5-diamine

C6H11N5 — CID 21018096

IUPAC1-(2-aminoprop-2-enyl)pyrazole-4,5-diamine
SMILESC=C(N)Cn1ncc(N)c1N
InChIInChI=1S/C6H11N5/c1-4(7)3-11-6(9)5(8)2-10-11/h2H,1,3,7-9H2
InChIKeyFRSTZHSXVUVQBJ-UHFFFAOYSA-N
MW153.19 g/mol
LogP-0.48
Rot. Bonds2

About 1-(2-aminoprop-2-enyl)pyrazole-4,5-diamine

1-(2-aminoprop-2-enyl)pyrazole-4,5-diamine (PubChem CID 21018096) has the molecular formula C6H11N5 and a molecular weight of 153.19 g/mol. Its IUPAC name is 1-(2-aminoprop-2-enyl)pyrazole-4,5-diamine.

Molecular Properties

Compound Name1-(2-aminoprop-2-enyl)pyrazole-4,5-diamine
PubChem CID21018096
Molecular FormulaC6H11N5
Molecular Weight153.19 g/mol
Exact Mass153.10
IUPAC Name1-(2-aminoprop-2-enyl)pyrazole-4,5-diamine
SMILESC=C(N)Cn1ncc(N)c1N
InChIInChI=1S/C6H11N5/c1-4(7)3-11-6(9)5(8)2-10-11/h2H,1,3,7-9H2
InChIKeyFRSTZHSXVUVQBJ-UHFFFAOYSA-N
XLogP-0.48
TPSA95.88 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.19
LogP ≤ 5-0.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(2-aminoprop-2-enyl)pyrazole-4,5-diamine?
The IUPAC name of 1-(2-aminoprop-2-enyl)pyrazole-4,5-diamine (CID 21018096) is 1-(2-aminoprop-2-enyl)pyrazole-4,5-diamine.
What is the SMILES notation for 1-(2-aminoprop-2-enyl)pyrazole-4,5-diamine?
The canonical SMILES for 1-(2-aminoprop-2-enyl)pyrazole-4,5-diamine is C=C(N)Cn1ncc(N)c1N.
What is the InChIKey of 1-(2-aminoprop-2-enyl)pyrazole-4,5-diamine?
The InChIKey is FRSTZHSXVUVQBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N5/c1-4(7)3-11-6(9)5(8)2-10-11/h2H,1,3,7-9H2.
What are the key properties of 1-(2-aminoprop-2-enyl)pyrazole-4,5-diamine?
1-(2-aminoprop-2-enyl)pyrazole-4,5-diamine has a molecular weight of 153.19 g/mol, XLogP of -0.48, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminoprop-2-enyl)pyrazole-4,5-diamine is sourced from PubChem (CID 21018096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).