N-(1-tert-butyl-3-cyclopentylpyrazol-5-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine

C19H26N6 — CID 170228381

IUPACN-(1-tert-butyl-3-cyclopentylpyrazol-5-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
SMILESCc1cc2c(Nc3cc(C4CCCC4)nn3C(C)(C)C)nccn2n1
InChIInChI=1S/C19H26N6/c1-13-11-16-18(20-9-10-24(16)22-13)21-17-12-15(14-7-5-6-8-14)23-25(17)19(2,3)4/h9-12,14H,5-8H2,1-4H3,(H,20,21)
InChIKeyRCDNZIRDJWBMDQ-UHFFFAOYSA-N
MW338.46 g/mol
LogP4.39
Rot. Bonds3

About N-(1-tert-butyl-3-cyclopentylpyrazol-5-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine

N-(1-tert-butyl-3-cyclopentylpyrazol-5-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine (PubChem CID 170228381) has the molecular formula C19H26N6 and a molecular weight of 338.46 g/mol. Its IUPAC name is N-(1-tert-butyl-3-cyclopentylpyrazol-5-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine.

Molecular Properties

Compound NameN-(1-tert-butyl-3-cyclopentylpyrazol-5-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
PubChem CID170228381
Molecular FormulaC19H26N6
Molecular Weight338.46 g/mol
Exact Mass338.22
IUPAC NameN-(1-tert-butyl-3-cyclopentylpyrazol-5-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
SMILESCc1cc2c(Nc3cc(C4CCCC4)nn3C(C)(C)C)nccn2n1
InChIInChI=1S/C19H26N6/c1-13-11-16-18(20-9-10-24(16)22-13)21-17-12-15(14-7-5-6-8-14)23-25(17)19(2,3)4/h9-12,14H,5-8H2,1-4H3,(H,20,21)
InChIKeyRCDNZIRDJWBMDQ-UHFFFAOYSA-N
XLogP4.39
TPSA60.04 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.46
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(1-tert-butyl-3-cyclopentylpyrazol-5-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine?
The IUPAC name of N-(1-tert-butyl-3-cyclopentylpyrazol-5-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine (CID 170228381) is N-(1-tert-butyl-3-cyclopentylpyrazol-5-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine.
What is the SMILES notation for N-(1-tert-butyl-3-cyclopentylpyrazol-5-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine?
The canonical SMILES for N-(1-tert-butyl-3-cyclopentylpyrazol-5-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine is Cc1cc2c(Nc3cc(C4CCCC4)nn3C(C)(C)C)nccn2n1.
What is the InChIKey of N-(1-tert-butyl-3-cyclopentylpyrazol-5-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine?
The InChIKey is RCDNZIRDJWBMDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N6/c1-13-11-16-18(20-9-10-24(16)22-13)21-17-12-15(14-7-5-6-8-14)23-25(17)19(2,3)4/h9-12,14H,5-8H2,1-4H3,(H,20,21).
What are the key properties of N-(1-tert-butyl-3-cyclopentylpyrazol-5-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine?
N-(1-tert-butyl-3-cyclopentylpyrazol-5-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine has a molecular weight of 338.46 g/mol, XLogP of 4.39, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-tert-butyl-3-cyclopentylpyrazol-5-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine is sourced from PubChem (CID 170228381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).