N-cyclopropyl-4-[3-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-6-yl]benzamide

C22H18N4O2 — CID 137001364

IUPACN-cyclopropyl-4-[3-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-6-yl]benzamide
SMILESO=C(NC1CC1)c1ccc(-c2cn3c(-c4ccc(O)cc4)cnc3cn2)cc1
InChIInChI=1S/C22H18N4O2/c27-18-9-5-15(6-10-18)20-11-24-21-12-23-19(13-26(20)21)14-1-3-16(4-2-14)22(28)25-17-7-8-17/h1-6,9-13,17,27H,7-8H2,(H,25,28)
InChIKeyOOHLLISXKRUFOE-UHFFFAOYSA-N
MW370.41 g/mol
LogP3.66
Rot. Bonds4

About N-cyclopropyl-4-[3-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-6-yl]benzamide

N-cyclopropyl-4-[3-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-6-yl]benzamide (PubChem CID 137001364) has the molecular formula C22H18N4O2 and a molecular weight of 370.41 g/mol. Its IUPAC name is N-cyclopropyl-4-[3-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-6-yl]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-4-[3-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-6-yl]benzamide
PubChem CID137001364
Molecular FormulaC22H18N4O2
Molecular Weight370.41 g/mol
Exact Mass370.14
IUPAC NameN-cyclopropyl-4-[3-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-6-yl]benzamide
SMILESO=C(NC1CC1)c1ccc(-c2cn3c(-c4ccc(O)cc4)cnc3cn2)cc1
InChIInChI=1S/C22H18N4O2/c27-18-9-5-15(6-10-18)20-11-24-21-12-23-19(13-26(20)21)14-1-3-16(4-2-14)22(28)25-17-7-8-17/h1-6,9-13,17,27H,7-8H2,(H,25,28)
InChIKeyOOHLLISXKRUFOE-UHFFFAOYSA-N
XLogP3.66
TPSA79.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.41
LogP ≤ 53.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-[3-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-6-yl]benzamide?
The IUPAC name of N-cyclopropyl-4-[3-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-6-yl]benzamide (CID 137001364) is N-cyclopropyl-4-[3-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-6-yl]benzamide.
What is the SMILES notation for N-cyclopropyl-4-[3-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-6-yl]benzamide?
The canonical SMILES for N-cyclopropyl-4-[3-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-6-yl]benzamide is O=C(NC1CC1)c1ccc(-c2cn3c(-c4ccc(O)cc4)cnc3cn2)cc1.
What is the InChIKey of N-cyclopropyl-4-[3-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-6-yl]benzamide?
The InChIKey is OOHLLISXKRUFOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N4O2/c27-18-9-5-15(6-10-18)20-11-24-21-12-23-19(13-26(20)21)14-1-3-16(4-2-14)22(28)25-17-7-8-17/h1-6,9-13,17,27H,7-8H2,(H,25,28).
What are the key properties of N-cyclopropyl-4-[3-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-6-yl]benzamide?
N-cyclopropyl-4-[3-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-6-yl]benzamide has a molecular weight of 370.41 g/mol, XLogP of 3.66, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-[3-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-6-yl]benzamide is sourced from PubChem (CID 137001364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).