2-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]-N-pyridin-3-ylacetamide

C22H26N6O — CID 90560854

IUPAC2-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]-N-pyridin-3-ylacetamide
SMILESO=C(CN1CCN(CCn2ccnc2-c2ccccc2)CC1)Nc1cccnc1
InChIInChI=1S/C22H26N6O/c29-21(25-20-7-4-8-23-17-20)18-27-13-11-26(12-14-27)15-16-28-10-9-24-22(28)19-5-2-1-3-6-19/h1-10,17H,11-16,18H2,(H,25,29)
InChIKeyPABYRWGCCBAWPK-UHFFFAOYSA-N
MW390.49 g/mol
LogP2.20
Rot. Bonds7

About 2-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]-N-pyridin-3-ylacetamide

2-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]-N-pyridin-3-ylacetamide (PubChem CID 90560854) has the molecular formula C22H26N6O and a molecular weight of 390.49 g/mol. Its IUPAC name is 2-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]-N-pyridin-3-ylacetamide.

Molecular Properties

Compound Name2-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]-N-pyridin-3-ylacetamide
PubChem CID90560854
Molecular FormulaC22H26N6O
Molecular Weight390.49 g/mol
Exact Mass390.22
IUPAC Name2-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]-N-pyridin-3-ylacetamide
SMILESO=C(CN1CCN(CCn2ccnc2-c2ccccc2)CC1)Nc1cccnc1
InChIInChI=1S/C22H26N6O/c29-21(25-20-7-4-8-23-17-20)18-27-13-11-26(12-14-27)15-16-28-10-9-24-22(28)19-5-2-1-3-6-19/h1-10,17H,11-16,18H2,(H,25,29)
InChIKeyPABYRWGCCBAWPK-UHFFFAOYSA-N
XLogP2.20
TPSA66.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.49
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-fluorophenyl)-2-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]acetamide
CID 90560761
2-[4-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperazin-1-yl]-N-pyridin-3-ylacetamide
CID 90561328
N-(3-nitrophenyl)-2-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]acetamide
CID 90560781
methyl 2-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]acetate
CID 90560846
1-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]ethanone
CID 90560576
2-morpholin-4-yl-N-pyridin-3-ylacetamide
CID 124786353
[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]-pyrazin-2-ylmethanone
CID 90560710
N-(6-methyl-1,3-benzothiazol-2-yl)-2-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]acetamide
CID 90560800
2-phenyl-1-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]ethanone
CID 90560661
2-piperazin-1-yl-N-pyridin-3-ylacetamide;hydrochloride
CID 156595313
N-(3-fluorophenyl)-2-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]acetamide
CID 90494417
[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]-pyridin-2-ylmethanone
CID 90560712

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]-N-pyridin-3-ylacetamide?
The IUPAC name of 2-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]-N-pyridin-3-ylacetamide (CID 90560854) is 2-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]-N-pyridin-3-ylacetamide.
What is the SMILES notation for 2-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]-N-pyridin-3-ylacetamide?
The canonical SMILES for 2-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]-N-pyridin-3-ylacetamide is O=C(CN1CCN(CCn2ccnc2-c2ccccc2)CC1)Nc1cccnc1.
What is the InChIKey of 2-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]-N-pyridin-3-ylacetamide?
The InChIKey is PABYRWGCCBAWPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N6O/c29-21(25-20-7-4-8-23-17-20)18-27-13-11-26(12-14-27)15-16-28-10-9-24-22(28)19-5-2-1-3-6-19/h1-10,17H,11-16,18H2,(H,25,29).
What are the key properties of 2-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]-N-pyridin-3-ylacetamide?
2-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]-N-pyridin-3-ylacetamide has a molecular weight of 390.49 g/mol, XLogP of 2.20, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]-N-pyridin-3-ylacetamide is sourced from PubChem (CID 90560854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).