N-cyclopropyl-6-[3-(6-methoxypyrazin-2-yl)-1H-indazol-5-yl]pyrazin-2-amine

C19H17N7O — CID 57387439

IUPACN-cyclopropyl-6-[3-(6-methoxypyrazin-2-yl)-1H-indazol-5-yl]pyrazin-2-amine
SMILESCOc1cncc(-c2n[nH]c3ccc(-c4cncc(NC5CC5)n4)cc23)n1
InChIInChI=1S/C19H17N7O/c1-27-18-10-21-8-16(24-18)19-13-6-11(2-5-14(13)25-26-19)15-7-20-9-17(23-15)22-12-3-4-12/h2,5-10,12H,3-4H2,1H3,(H,22,23)(H,25,26)
InChIKeyQBRMNJQRXJVWMK-UHFFFAOYSA-N
MW359.39 g/mol
LogP3.06
Rot. Bonds5

About N-cyclopropyl-6-[3-(6-methoxypyrazin-2-yl)-1H-indazol-5-yl]pyrazin-2-amine

N-cyclopropyl-6-[3-(6-methoxypyrazin-2-yl)-1H-indazol-5-yl]pyrazin-2-amine (PubChem CID 57387439) has the molecular formula C19H17N7O and a molecular weight of 359.39 g/mol. Its IUPAC name is N-cyclopropyl-6-[3-(6-methoxypyrazin-2-yl)-1H-indazol-5-yl]pyrazin-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-6-[3-(6-methoxypyrazin-2-yl)-1H-indazol-5-yl]pyrazin-2-amine
PubChem CID57387439
Molecular FormulaC19H17N7O
Molecular Weight359.39 g/mol
Exact Mass359.15
IUPAC NameN-cyclopropyl-6-[3-(6-methoxypyrazin-2-yl)-1H-indazol-5-yl]pyrazin-2-amine
SMILESCOc1cncc(-c2n[nH]c3ccc(-c4cncc(NC5CC5)n4)cc23)n1
InChIInChI=1S/C19H17N7O/c1-27-18-10-21-8-16(24-18)19-13-6-11(2-5-14(13)25-26-19)15-7-20-9-17(23-15)22-12-3-4-12/h2,5-10,12H,3-4H2,1H3,(H,22,23)(H,25,26)
InChIKeyQBRMNJQRXJVWMK-UHFFFAOYSA-N
XLogP3.06
TPSA101.50 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.39
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-6-[3-(6-methoxypyrazin-2-yl)-1H-indazol-5-yl]pyrazin-2-amine?
The IUPAC name of N-cyclopropyl-6-[3-(6-methoxypyrazin-2-yl)-1H-indazol-5-yl]pyrazin-2-amine (CID 57387439) is N-cyclopropyl-6-[3-(6-methoxypyrazin-2-yl)-1H-indazol-5-yl]pyrazin-2-amine.
What is the SMILES notation for N-cyclopropyl-6-[3-(6-methoxypyrazin-2-yl)-1H-indazol-5-yl]pyrazin-2-amine?
The canonical SMILES for N-cyclopropyl-6-[3-(6-methoxypyrazin-2-yl)-1H-indazol-5-yl]pyrazin-2-amine is COc1cncc(-c2n[nH]c3ccc(-c4cncc(NC5CC5)n4)cc23)n1.
What is the InChIKey of N-cyclopropyl-6-[3-(6-methoxypyrazin-2-yl)-1H-indazol-5-yl]pyrazin-2-amine?
The InChIKey is QBRMNJQRXJVWMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N7O/c1-27-18-10-21-8-16(24-18)19-13-6-11(2-5-14(13)25-26-19)15-7-20-9-17(23-15)22-12-3-4-12/h2,5-10,12H,3-4H2,1H3,(H,22,23)(H,25,26).
What are the key properties of N-cyclopropyl-6-[3-(6-methoxypyrazin-2-yl)-1H-indazol-5-yl]pyrazin-2-amine?
N-cyclopropyl-6-[3-(6-methoxypyrazin-2-yl)-1H-indazol-5-yl]pyrazin-2-amine has a molecular weight of 359.39 g/mol, XLogP of 3.06, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-6-[3-(6-methoxypyrazin-2-yl)-1H-indazol-5-yl]pyrazin-2-amine is sourced from PubChem (CID 57387439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).