N-(5-cyclopropyl-1H-pyrazol-3-yl)-7-(2-methoxy-5-methylphenyl)-8H-imidazo[1,2-a]pyrazin-5-amine

C20H22N6O — CID 173086981

IUPACN-(5-cyclopropyl-1H-pyrazol-3-yl)-7-(2-methoxy-5-methylphenyl)-8H-imidazo[1,2-a]pyrazin-5-amine
SMILESCOc1ccc(C)cc1N1C=C(Nc2cc(C3CC3)[nH]n2)n2ccnc2C1
InChIInChI=1S/C20H22N6O/c1-13-3-6-17(27-2)16(9-13)25-11-19-21-7-8-26(19)20(12-25)22-18-10-15(23-24-18)14-4-5-14/h3,6-10,12,14H,4-5,11H2,1-2H3,(H2,22,23,24)
InChIKeyWNVPENSPJVJBSQ-UHFFFAOYSA-N
MW362.44 g/mol
LogP3.69
Rot. Bonds5

About N-(5-cyclopropyl-1H-pyrazol-3-yl)-7-(2-methoxy-5-methylphenyl)-8H-imidazo[1,2-a]pyrazin-5-amine

N-(5-cyclopropyl-1H-pyrazol-3-yl)-7-(2-methoxy-5-methylphenyl)-8H-imidazo[1,2-a]pyrazin-5-amine (PubChem CID 173086981) has the molecular formula C20H22N6O and a molecular weight of 362.44 g/mol. Its IUPAC name is N-(5-cyclopropyl-1H-pyrazol-3-yl)-7-(2-methoxy-5-methylphenyl)-8H-imidazo[1,2-a]pyrazin-5-amine.

Molecular Properties

Compound NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-7-(2-methoxy-5-methylphenyl)-8H-imidazo[1,2-a]pyrazin-5-amine
PubChem CID173086981
Molecular FormulaC20H22N6O
Molecular Weight362.44 g/mol
Exact Mass362.19
IUPAC NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-7-(2-methoxy-5-methylphenyl)-8H-imidazo[1,2-a]pyrazin-5-amine
SMILESCOc1ccc(C)cc1N1C=C(Nc2cc(C3CC3)[nH]n2)n2ccnc2C1
InChIInChI=1S/C20H22N6O/c1-13-3-6-17(27-2)16(9-13)25-11-19-21-7-8-26(19)20(12-25)22-18-10-15(23-24-18)14-4-5-14/h3,6-10,12,14H,4-5,11H2,1-2H3,(H2,22,23,24)
InChIKeyWNVPENSPJVJBSQ-UHFFFAOYSA-N
XLogP3.69
TPSA71.00 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.44
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-7-(2-methoxy-5-methylphenyl)-8H-imidazo[1,2-a]pyrazin-5-amine?
The IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-7-(2-methoxy-5-methylphenyl)-8H-imidazo[1,2-a]pyrazin-5-amine (CID 173086981) is N-(5-cyclopropyl-1H-pyrazol-3-yl)-7-(2-methoxy-5-methylphenyl)-8H-imidazo[1,2-a]pyrazin-5-amine.
What is the SMILES notation for N-(5-cyclopropyl-1H-pyrazol-3-yl)-7-(2-methoxy-5-methylphenyl)-8H-imidazo[1,2-a]pyrazin-5-amine?
The canonical SMILES for N-(5-cyclopropyl-1H-pyrazol-3-yl)-7-(2-methoxy-5-methylphenyl)-8H-imidazo[1,2-a]pyrazin-5-amine is COc1ccc(C)cc1N1C=C(Nc2cc(C3CC3)[nH]n2)n2ccnc2C1.
What is the InChIKey of N-(5-cyclopropyl-1H-pyrazol-3-yl)-7-(2-methoxy-5-methylphenyl)-8H-imidazo[1,2-a]pyrazin-5-amine?
The InChIKey is WNVPENSPJVJBSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N6O/c1-13-3-6-17(27-2)16(9-13)25-11-19-21-7-8-26(19)20(12-25)22-18-10-15(23-24-18)14-4-5-14/h3,6-10,12,14H,4-5,11H2,1-2H3,(H2,22,23,24).
What are the key properties of N-(5-cyclopropyl-1H-pyrazol-3-yl)-7-(2-methoxy-5-methylphenyl)-8H-imidazo[1,2-a]pyrazin-5-amine?
N-(5-cyclopropyl-1H-pyrazol-3-yl)-7-(2-methoxy-5-methylphenyl)-8H-imidazo[1,2-a]pyrazin-5-amine has a molecular weight of 362.44 g/mol, XLogP of 3.69, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-1H-pyrazol-3-yl)-7-(2-methoxy-5-methylphenyl)-8H-imidazo[1,2-a]pyrazin-5-amine is sourced from PubChem (CID 173086981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).