3-ethyl-1,2-dihydropyrazole-3,5-diamine

C5H12N4 — CID 142854810

IUPAC3-ethyl-1,2-dihydropyrazole-3,5-diamine
SMILESCCC1(N)C=C(N)NN1
InChIInChI=1S/C5H12N4/c1-2-5(7)3-4(6)8-9-5/h3,8-9H,2,6-7H2,1H3
InChIKeyIBFIYQYKVMJVDV-UHFFFAOYSA-N
MW128.18 g/mol
LogP-1.04
Rot. Bonds1

About 3-ethyl-1,2-dihydropyrazole-3,5-diamine

3-ethyl-1,2-dihydropyrazole-3,5-diamine (PubChem CID 142854810) has the molecular formula C5H12N4 and a molecular weight of 128.18 g/mol. Its IUPAC name is 3-ethyl-1,2-dihydropyrazole-3,5-diamine.

Molecular Properties

Compound Name3-ethyl-1,2-dihydropyrazole-3,5-diamine
PubChem CID142854810
Molecular FormulaC5H12N4
Molecular Weight128.18 g/mol
Exact Mass128.11
IUPAC Name3-ethyl-1,2-dihydropyrazole-3,5-diamine
SMILESCCC1(N)C=C(N)NN1
InChIInChI=1S/C5H12N4/c1-2-5(7)3-4(6)8-9-5/h3,8-9H,2,6-7H2,1H3
InChIKeyIBFIYQYKVMJVDV-UHFFFAOYSA-N
XLogP-1.04
TPSA76.10 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.18
LogP ≤ 5-1.04
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 5-amino-3-ethyl-1,2-dihydropyrazole-3-carboxylate
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azane;2-ethyl-1H-pyrazolo[1,5-a]pyridin-2-amine
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6-ethyl-3,3,6-trimethylcyclohexa-1,4-dien-1-amine
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4-(1,3-thiazol-5-ylmethyl)-1H-pyrimidine-4,6-diamine
CID 154391224
2-(4,4-diethylpiperidin-1-yl)pyrimidin-5-amine
CID 63160997
(2,6-diamino-1H-pyridin-2-yl)methanol
CID 170695917
3-fluoro-2-hexoxyaniline
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(2-amino-6-fluorophenyl) propanoate
CID 70075863

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1,2-dihydropyrazole-3,5-diamine?
The IUPAC name of 3-ethyl-1,2-dihydropyrazole-3,5-diamine (CID 142854810) is 3-ethyl-1,2-dihydropyrazole-3,5-diamine.
What is the SMILES notation for 3-ethyl-1,2-dihydropyrazole-3,5-diamine?
The canonical SMILES for 3-ethyl-1,2-dihydropyrazole-3,5-diamine is CCC1(N)C=C(N)NN1.
What is the InChIKey of 3-ethyl-1,2-dihydropyrazole-3,5-diamine?
The InChIKey is IBFIYQYKVMJVDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N4/c1-2-5(7)3-4(6)8-9-5/h3,8-9H,2,6-7H2,1H3.
What are the key properties of 3-ethyl-1,2-dihydropyrazole-3,5-diamine?
3-ethyl-1,2-dihydropyrazole-3,5-diamine has a molecular weight of 128.18 g/mol, XLogP of -1.04, 1 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1,2-dihydropyrazole-3,5-diamine is sourced from PubChem (CID 142854810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).