1-[3-(benzylamino)imidazo[1,2-a]pyrazin-2-yl]naphthalen-2-ol

C23H18N4O — CID 138536025

IUPAC1-[3-(benzylamino)imidazo[1,2-a]pyrazin-2-yl]naphthalen-2-ol
SMILESOc1ccc2ccccc2c1-c1nc2cnccn2c1NCc1ccccc1
InChIInChI=1S/C23H18N4O/c28-19-11-10-17-8-4-5-9-18(17)21(19)22-23(25-14-16-6-2-1-3-7-16)27-13-12-24-15-20(27)26-22/h1-13,15,25,28H,14H2
InChIKeyNDZPODAXEXUQKN-UHFFFAOYSA-N
MW366.42 g/mol
LogP4.87
Rot. Bonds4

About 1-[3-(benzylamino)imidazo[1,2-a]pyrazin-2-yl]naphthalen-2-ol

1-[3-(benzylamino)imidazo[1,2-a]pyrazin-2-yl]naphthalen-2-ol (PubChem CID 138536025) has the molecular formula C23H18N4O and a molecular weight of 366.42 g/mol. Its IUPAC name is 1-[3-(benzylamino)imidazo[1,2-a]pyrazin-2-yl]naphthalen-2-ol.

Molecular Properties

Compound Name1-[3-(benzylamino)imidazo[1,2-a]pyrazin-2-yl]naphthalen-2-ol
PubChem CID138536025
Molecular FormulaC23H18N4O
Molecular Weight366.42 g/mol
Exact Mass366.15
IUPAC Name1-[3-(benzylamino)imidazo[1,2-a]pyrazin-2-yl]naphthalen-2-ol
SMILESOc1ccc2ccccc2c1-c1nc2cnccn2c1NCc1ccccc1
InChIInChI=1S/C23H18N4O/c28-19-11-10-17-8-4-5-9-18(17)21(19)22-23(25-14-16-6-2-1-3-7-16)27-13-12-24-15-20(27)26-22/h1-13,15,25,28H,14H2
InChIKeyNDZPODAXEXUQKN-UHFFFAOYSA-N
XLogP4.87
TPSA62.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 54.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[3-(benzylamino)imidazo[1,2-a]pyrazin-2-yl]naphthalen-2-ol?
The IUPAC name of 1-[3-(benzylamino)imidazo[1,2-a]pyrazin-2-yl]naphthalen-2-ol (CID 138536025) is 1-[3-(benzylamino)imidazo[1,2-a]pyrazin-2-yl]naphthalen-2-ol.
What is the SMILES notation for 1-[3-(benzylamino)imidazo[1,2-a]pyrazin-2-yl]naphthalen-2-ol?
The canonical SMILES for 1-[3-(benzylamino)imidazo[1,2-a]pyrazin-2-yl]naphthalen-2-ol is Oc1ccc2ccccc2c1-c1nc2cnccn2c1NCc1ccccc1.
What is the InChIKey of 1-[3-(benzylamino)imidazo[1,2-a]pyrazin-2-yl]naphthalen-2-ol?
The InChIKey is NDZPODAXEXUQKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N4O/c28-19-11-10-17-8-4-5-9-18(17)21(19)22-23(25-14-16-6-2-1-3-7-16)27-13-12-24-15-20(27)26-22/h1-13,15,25,28H,14H2.
What are the key properties of 1-[3-(benzylamino)imidazo[1,2-a]pyrazin-2-yl]naphthalen-2-ol?
1-[3-(benzylamino)imidazo[1,2-a]pyrazin-2-yl]naphthalen-2-ol has a molecular weight of 366.42 g/mol, XLogP of 4.87, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(benzylamino)imidazo[1,2-a]pyrazin-2-yl]naphthalen-2-ol is sourced from PubChem (CID 138536025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).