3-methyl-3-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,3-diamine

C13H21N5 — CID 106165731

IUPAC3-methyl-3-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,3-diamine
SMILESCCC(C)(CCN)Nc1nccn2nc(C)cc12
InChIInChI=1S/C13H21N5/c1-4-13(3,5-6-14)16-12-11-9-10(2)17-18(11)8-7-15-12/h7-9H,4-6,14H2,1-3H3,(H,15,16)
InChIKeyRAOQECRCPNKSGE-UHFFFAOYSA-N
MW247.35 g/mol
LogP1.97
Rot. Bonds5

About 3-methyl-3-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,3-diamine

3-methyl-3-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,3-diamine (PubChem CID 106165731) has the molecular formula C13H21N5 and a molecular weight of 247.35 g/mol. Its IUPAC name is 3-methyl-3-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,3-diamine.

Molecular Properties

Compound Name3-methyl-3-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,3-diamine
PubChem CID106165731
Molecular FormulaC13H21N5
Molecular Weight247.35 g/mol
Exact Mass247.18
IUPAC Name3-methyl-3-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,3-diamine
SMILESCCC(C)(CCN)Nc1nccn2nc(C)cc12
InChIInChI=1S/C13H21N5/c1-4-13(3,5-6-14)16-12-11-9-10(2)17-18(11)8-7-15-12/h7-9H,4-6,14H2,1-3H3,(H,15,16)
InChIKeyRAOQECRCPNKSGE-UHFFFAOYSA-N
XLogP1.97
TPSA68.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.35
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-methyl-3-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,3-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1,3-dichloro-2-methylpropan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 104734163
2-tert-butyl-N-(3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazin-4-amine
CID 106329795
2,3-dimethyl-2-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)butane-1,2-diamine
CID 104732818
2-(hydroxymethyl)-2-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]propane-1,3-diol
CID 107849242
N-(2,2-dimethylpropyl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 104730931
1-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)propane-1,2-diamine
CID 104732536
3-[(1-amino-3-methylpentan-3-yl)amino]-1-ethylpyrazin-2-one
CID 106165626
N-(5-chloro-2,2-dimethylpentyl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 106142206
2-methyl-N-(5,5,5-trifluoropentyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104731976
2-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,2-diamine
CID 104732620
3-amino-4-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]butan-2-ol
CID 104732599
2-methyl-N-[(5-methylpyrazin-2-yl)methyl]pyrazolo[1,5-a]pyrazin-4-amine
CID 104731375

Frequently Asked Questions

What is the IUPAC name of 3-methyl-3-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,3-diamine?
The IUPAC name of 3-methyl-3-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,3-diamine (CID 106165731) is 3-methyl-3-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,3-diamine.
What is the SMILES notation for 3-methyl-3-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,3-diamine?
The canonical SMILES for 3-methyl-3-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,3-diamine is CCC(C)(CCN)Nc1nccn2nc(C)cc12.
What is the InChIKey of 3-methyl-3-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,3-diamine?
The InChIKey is RAOQECRCPNKSGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5/c1-4-13(3,5-6-14)16-12-11-9-10(2)17-18(11)8-7-15-12/h7-9H,4-6,14H2,1-3H3,(H,15,16).
What are the key properties of 3-methyl-3-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,3-diamine?
3-methyl-3-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,3-diamine has a molecular weight of 247.35 g/mol, XLogP of 1.97, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,3-diamine is sourced from PubChem (CID 106165731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).