2-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrazin-4-amine

C17H18N4 — CID 104731297

IUPAC2-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrazin-4-amine
SMILESCc1cc2c(NC3CCc4ccccc4C3)nccn2n1
InChIInChI=1S/C17H18N4/c1-12-10-16-17(18-8-9-21(16)20-12)19-15-7-6-13-4-2-3-5-14(13)11-15/h2-5,8-10,15H,6-7,11H2,1H3,(H,18,19)
InChIKeyBDCMTTVLCWLGOX-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.01
Rot. Bonds2

About 2-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrazin-4-amine

2-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrazin-4-amine (PubChem CID 104731297) has the molecular formula C17H18N4 and a molecular weight of 278.36 g/mol. Its IUPAC name is 2-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrazin-4-amine.

Molecular Properties

Compound Name2-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrazin-4-amine
PubChem CID104731297
Molecular FormulaC17H18N4
Molecular Weight278.36 g/mol
Exact Mass278.15
IUPAC Name2-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrazin-4-amine
SMILESCc1cc2c(NC3CCc4ccccc4C3)nccn2n1
InChIInChI=1S/C17H18N4/c1-12-10-16-17(18-8-9-21(16)20-12)19-15-7-6-13-4-2-3-5-14(13)11-15/h2-5,8-10,15H,6-7,11H2,1H3,(H,18,19)
InChIKeyBDCMTTVLCWLGOX-UHFFFAOYSA-N
XLogP3.01
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrazin-4-amine?
The IUPAC name of 2-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrazin-4-amine (CID 104731297) is 2-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrazin-4-amine.
What is the SMILES notation for 2-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrazin-4-amine?
The canonical SMILES for 2-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrazin-4-amine is Cc1cc2c(NC3CCc4ccccc4C3)nccn2n1.
What is the InChIKey of 2-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrazin-4-amine?
The InChIKey is BDCMTTVLCWLGOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4/c1-12-10-16-17(18-8-9-21(16)20-12)19-15-7-6-13-4-2-3-5-14(13)11-15/h2-5,8-10,15H,6-7,11H2,1H3,(H,18,19).
What are the key properties of 2-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrazin-4-amine?
2-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrazin-4-amine has a molecular weight of 278.36 g/mol, XLogP of 3.01, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrazin-4-amine is sourced from PubChem (CID 104731297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).