[2-[8-[4-[2-(diethylamino)ethyl]piperazin-1-yl]imidazo[1,2-a]pyrazin-5-yl]phenyl]methanol

C23H32N6O — CID 126474976

IUPAC[2-[8-[4-[2-(diethylamino)ethyl]piperazin-1-yl]imidazo[1,2-a]pyrazin-5-yl]phenyl]methanol
SMILESCCN(CC)CCN1CCN(c2ncc(-c3ccccc3CO)n3ccnc23)CC1
InChIInChI=1S/C23H32N6O/c1-3-26(4-2)11-12-27-13-15-28(16-14-27)22-23-24-9-10-29(23)21(17-25-22)20-8-6-5-7-19(20)18-30/h5-10,17,30H,3-4,11-16,18H2,1-2H3
InChIKeyOWIAKELWBFPHPC-UHFFFAOYSA-N
MW408.55 g/mol
LogP2.35
Rot. Bonds8

About [2-[8-[4-[2-(diethylamino)ethyl]piperazin-1-yl]imidazo[1,2-a]pyrazin-5-yl]phenyl]methanol

[2-[8-[4-[2-(diethylamino)ethyl]piperazin-1-yl]imidazo[1,2-a]pyrazin-5-yl]phenyl]methanol (PubChem CID 126474976) has the molecular formula C23H32N6O and a molecular weight of 408.55 g/mol. Its IUPAC name is [2-[8-[4-[2-(diethylamino)ethyl]piperazin-1-yl]imidazo[1,2-a]pyrazin-5-yl]phenyl]methanol.

Molecular Properties

Compound Name[2-[8-[4-[2-(diethylamino)ethyl]piperazin-1-yl]imidazo[1,2-a]pyrazin-5-yl]phenyl]methanol
PubChem CID126474976
Molecular FormulaC23H32N6O
Molecular Weight408.55 g/mol
Exact Mass408.26
IUPAC Name[2-[8-[4-[2-(diethylamino)ethyl]piperazin-1-yl]imidazo[1,2-a]pyrazin-5-yl]phenyl]methanol
SMILESCCN(CC)CCN1CCN(c2ncc(-c3ccccc3CO)n3ccnc23)CC1
InChIInChI=1S/C23H32N6O/c1-3-26(4-2)11-12-27-13-15-28(16-14-27)22-23-24-9-10-29(23)21(17-25-22)20-8-6-5-7-19(20)18-30/h5-10,17,30H,3-4,11-16,18H2,1-2H3
InChIKeyOWIAKELWBFPHPC-UHFFFAOYSA-N
XLogP2.35
TPSA60.14 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.55
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of [2-[8-[4-[2-(diethylamino)ethyl]piperazin-1-yl]imidazo[1,2-a]pyrazin-5-yl]phenyl]methanol?
The IUPAC name of [2-[8-[4-[2-(diethylamino)ethyl]piperazin-1-yl]imidazo[1,2-a]pyrazin-5-yl]phenyl]methanol (CID 126474976) is [2-[8-[4-[2-(diethylamino)ethyl]piperazin-1-yl]imidazo[1,2-a]pyrazin-5-yl]phenyl]methanol.
What is the SMILES notation for [2-[8-[4-[2-(diethylamino)ethyl]piperazin-1-yl]imidazo[1,2-a]pyrazin-5-yl]phenyl]methanol?
The canonical SMILES for [2-[8-[4-[2-(diethylamino)ethyl]piperazin-1-yl]imidazo[1,2-a]pyrazin-5-yl]phenyl]methanol is CCN(CC)CCN1CCN(c2ncc(-c3ccccc3CO)n3ccnc23)CC1.
What is the InChIKey of [2-[8-[4-[2-(diethylamino)ethyl]piperazin-1-yl]imidazo[1,2-a]pyrazin-5-yl]phenyl]methanol?
The InChIKey is OWIAKELWBFPHPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N6O/c1-3-26(4-2)11-12-27-13-15-28(16-14-27)22-23-24-9-10-29(23)21(17-25-22)20-8-6-5-7-19(20)18-30/h5-10,17,30H,3-4,11-16,18H2,1-2H3.
What are the key properties of [2-[8-[4-[2-(diethylamino)ethyl]piperazin-1-yl]imidazo[1,2-a]pyrazin-5-yl]phenyl]methanol?
[2-[8-[4-[2-(diethylamino)ethyl]piperazin-1-yl]imidazo[1,2-a]pyrazin-5-yl]phenyl]methanol has a molecular weight of 408.55 g/mol, XLogP of 2.35, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[8-[4-[2-(diethylamino)ethyl]piperazin-1-yl]imidazo[1,2-a]pyrazin-5-yl]phenyl]methanol is sourced from PubChem (CID 126474976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).