cyclopentane;N,N-dimethylprop-2-enamide;6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine

C20H28N6O — CID 168886482

IUPACcyclopentane;N,N-dimethylprop-2-enamide;6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine
SMILESC1CCCC1.C=CC(=O)N(C)C.Cn1cc(-c2cn3nccc3cn2)cn1
InChIInChI=1S/C10H9N5.C5H9NO.C5H10/c1-14-6-8(4-13-14)10-7-15-9(5-11-10)2-3-12-15;1-4-5(7)6(2)3;1-2-4-5-3-1/h2-7H,1H3;4H,1H2,2-3H3;1-5H2
InChIKeyKAXWEJSSHQAZSC-UHFFFAOYSA-N
MW368.49 g/mol
LogP3.34
Rot. Bonds2

About cyclopentane;N,N-dimethylprop-2-enamide;6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine

cyclopentane;N,N-dimethylprop-2-enamide;6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine (PubChem CID 168886482) has the molecular formula C20H28N6O and a molecular weight of 368.49 g/mol. Its IUPAC name is cyclopentane;N,N-dimethylprop-2-enamide;6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine.

Molecular Properties

Compound Namecyclopentane;N,N-dimethylprop-2-enamide;6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine
PubChem CID168886482
Molecular FormulaC20H28N6O
Molecular Weight368.49 g/mol
Exact Mass368.23
IUPAC Namecyclopentane;N,N-dimethylprop-2-enamide;6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine
SMILESC1CCCC1.C=CC(=O)N(C)C.Cn1cc(-c2cn3nccc3cn2)cn1
InChIInChI=1S/C10H9N5.C5H9NO.C5H10/c1-14-6-8(4-13-14)10-7-15-9(5-11-10)2-3-12-15;1-4-5(7)6(2)3;1-2-4-5-3-1/h2-7H,1H3;4H,1H2,2-3H3;1-5H2
InChIKeyKAXWEJSSHQAZSC-UHFFFAOYSA-N
XLogP3.34
TPSA68.32 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.49
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of cyclopentane;N,N-dimethylprop-2-enamide;6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine?
The IUPAC name of cyclopentane;N,N-dimethylprop-2-enamide;6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine (CID 168886482) is cyclopentane;N,N-dimethylprop-2-enamide;6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine.
What is the SMILES notation for cyclopentane;N,N-dimethylprop-2-enamide;6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine?
The canonical SMILES for cyclopentane;N,N-dimethylprop-2-enamide;6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine is C1CCCC1.C=CC(=O)N(C)C.Cn1cc(-c2cn3nccc3cn2)cn1.
What is the InChIKey of cyclopentane;N,N-dimethylprop-2-enamide;6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine?
The InChIKey is KAXWEJSSHQAZSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N5.C5H9NO.C5H10/c1-14-6-8(4-13-14)10-7-15-9(5-11-10)2-3-12-15;1-4-5(7)6(2)3;1-2-4-5-3-1/h2-7H,1H3;4H,1H2,2-3H3;1-5H2.
What are the key properties of cyclopentane;N,N-dimethylprop-2-enamide;6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine?
cyclopentane;N,N-dimethylprop-2-enamide;6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine has a molecular weight of 368.49 g/mol, XLogP of 3.34, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentane;N,N-dimethylprop-2-enamide;6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine is sourced from PubChem (CID 168886482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).