5-N-(2-aminoethyl)-1-(4-amino-2-methylbutan-2-yl)pyrazole-4,5-diamine

C10H22N6 — CID 69434318

IUPAC5-N-(2-aminoethyl)-1-(4-amino-2-methylbutan-2-yl)pyrazole-4,5-diamine
SMILESCC(C)(CCN)n1ncc(N)c1NCCN
InChIInChI=1S/C10H22N6/c1-10(2,3-4-11)16-9(14-6-5-12)8(13)7-15-16/h7,14H,3-6,11-13H2,1-2H3
InChIKeyFXMAFZQUMWESBY-UHFFFAOYSA-N
MW226.33 g/mol
LogP-0.08
Rot. Bonds6

About 5-N-(2-aminoethyl)-1-(4-amino-2-methylbutan-2-yl)pyrazole-4,5-diamine

5-N-(2-aminoethyl)-1-(4-amino-2-methylbutan-2-yl)pyrazole-4,5-diamine (PubChem CID 69434318) has the molecular formula C10H22N6 and a molecular weight of 226.33 g/mol. Its IUPAC name is 5-N-(2-aminoethyl)-1-(4-amino-2-methylbutan-2-yl)pyrazole-4,5-diamine.

Molecular Properties

Compound Name5-N-(2-aminoethyl)-1-(4-amino-2-methylbutan-2-yl)pyrazole-4,5-diamine
PubChem CID69434318
Molecular FormulaC10H22N6
Molecular Weight226.33 g/mol
Exact Mass226.19
IUPAC Name5-N-(2-aminoethyl)-1-(4-amino-2-methylbutan-2-yl)pyrazole-4,5-diamine
SMILESCC(C)(CCN)n1ncc(N)c1NCCN
InChIInChI=1S/C10H22N6/c1-10(2,3-4-11)16-9(14-6-5-12)8(13)7-15-16/h7,14H,3-6,11-13H2,1-2H3
InChIKeyFXMAFZQUMWESBY-UHFFFAOYSA-N
XLogP-0.08
TPSA107.91 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.33
LogP ≤ 5-0.08
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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Related Compounds

5-N-(2-aminoethyl)-1-(3-methoxypropyl)pyrazole-4,5-diamine
CID 58913962
1-tert-butyl-5-chloropyrazol-4-amine
CID 115014238
2-[[4-amino-1-(2-hydroxyethyl)pyrazol-5-yl]amino]ethanol
CID 22918623
4-(aminomethyl)-1-tert-butylpyrazol-5-amine
CID 115069508
N'-(2-methylpyrimidin-5-yl)ethane-1,2-diamine
CID 84649652
3-(4,5-diaminopyrazol-1-yl)-3-methylbutan-2-ol
CID 58980370
1-[4-amino-5-(4-hydroxybutylamino)pyrazol-1-yl]butan-2-ol
CID 59000041
4-N-(2-aminoethyl)quinoline-3,4-diamine
CID 103963227
5-N-(tert-butylsulfamoyl)-1-methylpyrazole-4,5-diamine
CID 114804868
N-(1-amino-2-methylpropan-2-yl)-1-tert-butyl-5-methylpyrazole-4-carboxamide;hydrochloride
CID 119521515
1-tert-butyl-4-ethylpyrazol-5-amine
CID 68938283
N-(2-aminoethyl)-1-(difluoromethyl)-5-methylpyrazole-4-sulfonamide
CID 19621228

Frequently Asked Questions

What is the IUPAC name of 5-N-(2-aminoethyl)-1-(4-amino-2-methylbutan-2-yl)pyrazole-4,5-diamine?
The IUPAC name of 5-N-(2-aminoethyl)-1-(4-amino-2-methylbutan-2-yl)pyrazole-4,5-diamine (CID 69434318) is 5-N-(2-aminoethyl)-1-(4-amino-2-methylbutan-2-yl)pyrazole-4,5-diamine.
What is the SMILES notation for 5-N-(2-aminoethyl)-1-(4-amino-2-methylbutan-2-yl)pyrazole-4,5-diamine?
The canonical SMILES for 5-N-(2-aminoethyl)-1-(4-amino-2-methylbutan-2-yl)pyrazole-4,5-diamine is CC(C)(CCN)n1ncc(N)c1NCCN.
What is the InChIKey of 5-N-(2-aminoethyl)-1-(4-amino-2-methylbutan-2-yl)pyrazole-4,5-diamine?
The InChIKey is FXMAFZQUMWESBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N6/c1-10(2,3-4-11)16-9(14-6-5-12)8(13)7-15-16/h7,14H,3-6,11-13H2,1-2H3.
What are the key properties of 5-N-(2-aminoethyl)-1-(4-amino-2-methylbutan-2-yl)pyrazole-4,5-diamine?
5-N-(2-aminoethyl)-1-(4-amino-2-methylbutan-2-yl)pyrazole-4,5-diamine has a molecular weight of 226.33 g/mol, XLogP of -0.08, 6 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(2-aminoethyl)-1-(4-amino-2-methylbutan-2-yl)pyrazole-4,5-diamine is sourced from PubChem (CID 69434318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).