N-cyclopropyl-4-[8-(2-hydroxyethylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide

C18H19N5O2 — CID 57379118

IUPACN-cyclopropyl-4-[8-(2-hydroxyethylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide
SMILESO=C(NC1CC1)c1ccc(-c2cnc3c(NCCO)nccn23)cc1
InChIInChI=1S/C18H19N5O2/c24-10-8-20-16-17-21-11-15(23(17)9-7-19-16)12-1-3-13(4-2-12)18(25)22-14-5-6-14/h1-4,7,9,11,14,24H,5-6,8,10H2,(H,19,20)(H,22,25)
InChIKeyJIWXRIDKNPUWBG-UHFFFAOYSA-N
MW337.38 g/mol
LogP1.69
Rot. Bonds6

About N-cyclopropyl-4-[8-(2-hydroxyethylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide

N-cyclopropyl-4-[8-(2-hydroxyethylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide (PubChem CID 57379118) has the molecular formula C18H19N5O2 and a molecular weight of 337.38 g/mol. Its IUPAC name is N-cyclopropyl-4-[8-(2-hydroxyethylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-4-[8-(2-hydroxyethylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide
PubChem CID57379118
Molecular FormulaC18H19N5O2
Molecular Weight337.38 g/mol
Exact Mass337.15
IUPAC NameN-cyclopropyl-4-[8-(2-hydroxyethylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide
SMILESO=C(NC1CC1)c1ccc(-c2cnc3c(NCCO)nccn23)cc1
InChIInChI=1S/C18H19N5O2/c24-10-8-20-16-17-21-11-15(23(17)9-7-19-16)12-1-3-13(4-2-12)18(25)22-14-5-6-14/h1-4,7,9,11,14,24H,5-6,8,10H2,(H,19,20)(H,22,25)
InChIKeyJIWXRIDKNPUWBG-UHFFFAOYSA-N
XLogP1.69
TPSA91.55 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 51.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-[8-(2-hydroxyethylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide?
The IUPAC name of N-cyclopropyl-4-[8-(2-hydroxyethylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide (CID 57379118) is N-cyclopropyl-4-[8-(2-hydroxyethylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide.
What is the SMILES notation for N-cyclopropyl-4-[8-(2-hydroxyethylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide?
The canonical SMILES for N-cyclopropyl-4-[8-(2-hydroxyethylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide is O=C(NC1CC1)c1ccc(-c2cnc3c(NCCO)nccn23)cc1.
What is the InChIKey of N-cyclopropyl-4-[8-(2-hydroxyethylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide?
The InChIKey is JIWXRIDKNPUWBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O2/c24-10-8-20-16-17-21-11-15(23(17)9-7-19-16)12-1-3-13(4-2-12)18(25)22-14-5-6-14/h1-4,7,9,11,14,24H,5-6,8,10H2,(H,19,20)(H,22,25).
What are the key properties of N-cyclopropyl-4-[8-(2-hydroxyethylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide?
N-cyclopropyl-4-[8-(2-hydroxyethylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide has a molecular weight of 337.38 g/mol, XLogP of 1.69, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-[8-(2-hydroxyethylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide is sourced from PubChem (CID 57379118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).