3-(4-acetylpiperazin-1-yl)-N-(2-phenylethyl)indolizine-6-carboxamide

C23H26N4O2 — CID 97447966

IUPAC3-(4-acetylpiperazin-1-yl)-N-(2-phenylethyl)indolizine-6-carboxamide
SMILESCC(=O)N1CCN(c2ccc3ccc(C(=O)NCCc4ccccc4)cn23)CC1
InChIInChI=1S/C23H26N4O2/c1-18(28)25-13-15-26(16-14-25)22-10-9-21-8-7-20(17-27(21)22)23(29)24-12-11-19-5-3-2-4-6-19/h2-10,17H,11-16H2,1H3,(H,24,29)
InChIKeyRGCLMVJUWWVKRH-UHFFFAOYSA-N
MW390.49 g/mol
LogP2.58
Rot. Bonds5

About 3-(4-acetylpiperazin-1-yl)-N-(2-phenylethyl)indolizine-6-carboxamide

3-(4-acetylpiperazin-1-yl)-N-(2-phenylethyl)indolizine-6-carboxamide (PubChem CID 97447966) has the molecular formula C23H26N4O2 and a molecular weight of 390.49 g/mol. Its IUPAC name is 3-(4-acetylpiperazin-1-yl)-N-(2-phenylethyl)indolizine-6-carboxamide.

Molecular Properties

Compound Name3-(4-acetylpiperazin-1-yl)-N-(2-phenylethyl)indolizine-6-carboxamide
PubChem CID97447966
Molecular FormulaC23H26N4O2
Molecular Weight390.49 g/mol
Exact Mass390.21
IUPAC Name3-(4-acetylpiperazin-1-yl)-N-(2-phenylethyl)indolizine-6-carboxamide
SMILESCC(=O)N1CCN(c2ccc3ccc(C(=O)NCCc4ccccc4)cn23)CC1
InChIInChI=1S/C23H26N4O2/c1-18(28)25-13-15-26(16-14-25)22-10-9-21-8-7-20(17-27(21)22)23(29)24-12-11-19-5-3-2-4-6-19/h2-10,17H,11-16H2,1H3,(H,24,29)
InChIKeyRGCLMVJUWWVKRH-UHFFFAOYSA-N
XLogP2.58
TPSA57.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.49
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4-methylsulfonylpiperazin-1-yl)-N-(2-phenylethyl)indolizine-6-carboxamide
CID 97362437
3-(4-acetylpiperazin-1-yl)-N-[2-(3-methoxyphenyl)ethyl]indolizine-6-carboxamide
CID 97447981
3-(4-acetylpiperazin-1-yl)-N-(2-pyridin-2-ylethyl)indolizine-6-carboxamide
CID 97447978
3-(4-acetylpiperazin-1-yl)-N-(pyridin-2-ylmethyl)indolizine-6-carboxamide
CID 97447967
N-benzyl-3-[4-[2-(dimethylamino)acetyl]piperazin-1-yl]indolizine-6-carboxamide
CID 97448020
N-[2-(3-fluorophenyl)ethyl]-3-(4-methylpiperidin-1-yl)indolizine-6-carboxamide
CID 97441664
3-(4-propan-2-ylpiperazin-1-yl)-N-(2-pyridin-2-ylethyl)indolizine-6-carboxamide
CID 97448096
3-(4-methylpiperidin-1-yl)-N-(2-pyridin-2-ylethyl)indolizine-6-carboxamide
CID 97407087
1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide
CID 984633
3-(4-methylpiperazin-1-yl)-N-(pyridin-4-ylmethyl)indolizine-6-carboxamide
CID 97447891
1-(4-acetylpiperazine-1-carbonyl)-N-(2-phenylethyl)cyclopropane-1-carboxamide
CID 108974430
5-(4-acetylpiperazin-1-yl)-N-(3-phenylpropyl)pyridine-3-carboxamide
CID 109231191

Frequently Asked Questions

What is the IUPAC name of 3-(4-acetylpiperazin-1-yl)-N-(2-phenylethyl)indolizine-6-carboxamide?
The IUPAC name of 3-(4-acetylpiperazin-1-yl)-N-(2-phenylethyl)indolizine-6-carboxamide (CID 97447966) is 3-(4-acetylpiperazin-1-yl)-N-(2-phenylethyl)indolizine-6-carboxamide.
What is the SMILES notation for 3-(4-acetylpiperazin-1-yl)-N-(2-phenylethyl)indolizine-6-carboxamide?
The canonical SMILES for 3-(4-acetylpiperazin-1-yl)-N-(2-phenylethyl)indolizine-6-carboxamide is CC(=O)N1CCN(c2ccc3ccc(C(=O)NCCc4ccccc4)cn23)CC1.
What is the InChIKey of 3-(4-acetylpiperazin-1-yl)-N-(2-phenylethyl)indolizine-6-carboxamide?
The InChIKey is RGCLMVJUWWVKRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O2/c1-18(28)25-13-15-26(16-14-25)22-10-9-21-8-7-20(17-27(21)22)23(29)24-12-11-19-5-3-2-4-6-19/h2-10,17H,11-16H2,1H3,(H,24,29).
What are the key properties of 3-(4-acetylpiperazin-1-yl)-N-(2-phenylethyl)indolizine-6-carboxamide?
3-(4-acetylpiperazin-1-yl)-N-(2-phenylethyl)indolizine-6-carboxamide has a molecular weight of 390.49 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-acetylpiperazin-1-yl)-N-(2-phenylethyl)indolizine-6-carboxamide is sourced from PubChem (CID 97447966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).