N-(1-amino-3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazine-3-carboxamide

C13H19N5O — CID 106164842

IUPACN-(1-amino-3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazine-3-carboxamide
SMILESCCC(C)(CCN)NC(=O)c1cnn2ccncc12
InChIInChI=1S/C13H19N5O/c1-3-13(2,4-5-14)17-12(19)10-8-16-18-7-6-15-9-11(10)18/h6-9H,3-5,14H2,1-2H3,(H,17,19)
InChIKeyZHFCOTXFMAEQQY-UHFFFAOYSA-N
MW261.33 g/mol
LogP0.98
Rot. Bonds5

About N-(1-amino-3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazine-3-carboxamide

N-(1-amino-3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazine-3-carboxamide (PubChem CID 106164842) has the molecular formula C13H19N5O and a molecular weight of 261.33 g/mol. Its IUPAC name is N-(1-amino-3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazine-3-carboxamide.

Molecular Properties

Compound NameN-(1-amino-3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazine-3-carboxamide
PubChem CID106164842
Molecular FormulaC13H19N5O
Molecular Weight261.33 g/mol
Exact Mass261.16
IUPAC NameN-(1-amino-3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazine-3-carboxamide
SMILESCCC(C)(CCN)NC(=O)c1cnn2ccncc12
InChIInChI=1S/C13H19N5O/c1-3-13(2,4-5-14)17-12(19)10-8-16-18-7-6-15-9-11(10)18/h6-9H,3-5,14H2,1-2H3,(H,17,19)
InChIKeyZHFCOTXFMAEQQY-UHFFFAOYSA-N
XLogP0.98
TPSA85.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.33
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1,3-dibromo-2-methylpropan-2-yl)pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 103122794
N-(1-bromo-2-methylpropan-2-yl)pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 103122666
N-(1-aminopentan-3-yl)pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 103115859
N-[2-(bromomethyl)-2-ethylbutyl]pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 106255619
N-(1-amino-4-methylpentan-3-yl)pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 106356751
N-(1-amino-3-methylpentan-3-yl)-3-methoxypyridine-4-carboxamide
CID 106164489
ethyl 2-(pyrazolo[1,5-a]pyrazine-3-carbonylamino)propanoate
CID 103121176
pyrazolo[1,5-a]pyrazine-3-carboxylic acid
CID 67123720
N-(1-hydroxybutan-2-yl)pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 103120076
N-(2-hydroxy-4,4-dimethylpentyl)pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 107155250
N-pent-3-ynylpyrazolo[1,5-a]pyrazine-3-carboxamide
CID 103122096
1-pyrazolo[1,5-a]pyrazin-3-ylbutan-1-one
CID 103123927

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazine-3-carboxamide?
The IUPAC name of N-(1-amino-3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazine-3-carboxamide (CID 106164842) is N-(1-amino-3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazine-3-carboxamide.
What is the SMILES notation for N-(1-amino-3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazine-3-carboxamide?
The canonical SMILES for N-(1-amino-3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazine-3-carboxamide is CCC(C)(CCN)NC(=O)c1cnn2ccncc12.
What is the InChIKey of N-(1-amino-3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazine-3-carboxamide?
The InChIKey is ZHFCOTXFMAEQQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5O/c1-3-13(2,4-5-14)17-12(19)10-8-16-18-7-6-15-9-11(10)18/h6-9H,3-5,14H2,1-2H3,(H,17,19).
What are the key properties of N-(1-amino-3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazine-3-carboxamide?
N-(1-amino-3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazine-3-carboxamide has a molecular weight of 261.33 g/mol, XLogP of 0.98, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazine-3-carboxamide is sourced from PubChem (CID 106164842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).