N,2-dimethyl-N'-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)propane-1,3-diamine

C14H23N5 — CID 104732791

IUPACN,2-dimethyl-N'-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)propane-1,3-diamine
SMILESCNCC(C)CNc1nccn2nc(C(C)C)cc12
InChIInChI=1S/C14H23N5/c1-10(2)12-7-13-14(16-5-6-19(13)18-12)17-9-11(3)8-15-4/h5-7,10-11,15H,8-9H2,1-4H3,(H,16,17)
InChIKeyIOYGUMONCHFPIR-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.12
Rot. Bonds6

About N,2-dimethyl-N'-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)propane-1,3-diamine

N,2-dimethyl-N'-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)propane-1,3-diamine (PubChem CID 104732791) has the molecular formula C14H23N5 and a molecular weight of 261.37 g/mol. Its IUPAC name is N,2-dimethyl-N'-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)propane-1,3-diamine.

Molecular Properties

Compound NameN,2-dimethyl-N'-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)propane-1,3-diamine
PubChem CID104732791
Molecular FormulaC14H23N5
Molecular Weight261.37 g/mol
Exact Mass261.20
IUPAC NameN,2-dimethyl-N'-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)propane-1,3-diamine
SMILESCNCC(C)CNc1nccn2nc(C(C)C)cc12
InChIInChI=1S/C14H23N5/c1-10(2)12-7-13-14(16-5-6-19(13)18-12)17-9-11(3)8-15-4/h5-7,10-11,15H,8-9H2,1-4H3,(H,16,17)
InChIKeyIOYGUMONCHFPIR-UHFFFAOYSA-N
XLogP2.12
TPSA54.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-3-[(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)amino]propanoic acid
CID 113446134
4,4-dimethyl-1-[(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)amino]pentan-2-ol
CID 107153114
N-[(4-methylphenyl)methyl]-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine
CID 104730531
2-[[(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]butanoic acid
CID 104729603
N-(3-chlorobutyl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine
CID 113446632
N-(1H-imidazol-2-ylmethyl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine
CID 104731628
1-N-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,4-diamine
CID 106127800
N-(2-methoxy-2-methylpropyl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine
CID 104762524
N-octyl-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine
CID 104731980
2-tert-butyl-N-(3-chloro-2-methylpropyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104733993
N'-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)butane-1,4-diamine
CID 104730160
methyl 2-[(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)amino]acetate
CID 104730488

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N'-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)propane-1,3-diamine?
The IUPAC name of N,2-dimethyl-N'-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)propane-1,3-diamine (CID 104732791) is N,2-dimethyl-N'-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)propane-1,3-diamine.
What is the SMILES notation for N,2-dimethyl-N'-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)propane-1,3-diamine?
The canonical SMILES for N,2-dimethyl-N'-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)propane-1,3-diamine is CNCC(C)CNc1nccn2nc(C(C)C)cc12.
What is the InChIKey of N,2-dimethyl-N'-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)propane-1,3-diamine?
The InChIKey is IOYGUMONCHFPIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5/c1-10(2)12-7-13-14(16-5-6-19(13)18-12)17-9-11(3)8-15-4/h5-7,10-11,15H,8-9H2,1-4H3,(H,16,17).
What are the key properties of N,2-dimethyl-N'-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)propane-1,3-diamine?
N,2-dimethyl-N'-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)propane-1,3-diamine has a molecular weight of 261.37 g/mol, XLogP of 2.12, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N'-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)propane-1,3-diamine is sourced from PubChem (CID 104732791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).