3-(4-propan-2-ylpiperazin-1-yl)-N-(2-pyridin-2-ylethyl)indolizine-6-carboxamide

C23H29N5O — CID 97448096

IUPAC3-(4-propan-2-ylpiperazin-1-yl)-N-(2-pyridin-2-ylethyl)indolizine-6-carboxamide
SMILESCC(C)N1CCN(c2ccc3ccc(C(=O)NCCc4ccccn4)cn23)CC1
InChIInChI=1S/C23H29N5O/c1-18(2)26-13-15-27(16-14-26)22-9-8-21-7-6-19(17-28(21)22)23(29)25-12-10-20-5-3-4-11-24-20/h3-9,11,17-18H,10,12-16H2,1-2H3,(H,25,29)
InChIKeyONLCOKBWYRSIQG-UHFFFAOYSA-N
MW391.52 g/mol
LogP2.84
Rot. Bonds6

About 3-(4-propan-2-ylpiperazin-1-yl)-N-(2-pyridin-2-ylethyl)indolizine-6-carboxamide

3-(4-propan-2-ylpiperazin-1-yl)-N-(2-pyridin-2-ylethyl)indolizine-6-carboxamide (PubChem CID 97448096) has the molecular formula C23H29N5O and a molecular weight of 391.52 g/mol. Its IUPAC name is 3-(4-propan-2-ylpiperazin-1-yl)-N-(2-pyridin-2-ylethyl)indolizine-6-carboxamide.

Molecular Properties

Compound Name3-(4-propan-2-ylpiperazin-1-yl)-N-(2-pyridin-2-ylethyl)indolizine-6-carboxamide
PubChem CID97448096
Molecular FormulaC23H29N5O
Molecular Weight391.52 g/mol
Exact Mass391.24
IUPAC Name3-(4-propan-2-ylpiperazin-1-yl)-N-(2-pyridin-2-ylethyl)indolizine-6-carboxamide
SMILESCC(C)N1CCN(c2ccc3ccc(C(=O)NCCc4ccccn4)cn23)CC1
InChIInChI=1S/C23H29N5O/c1-18(2)26-13-15-27(16-14-26)22-9-8-21-7-6-19(17-28(21)22)23(29)25-12-10-20-5-3-4-11-24-20/h3-9,11,17-18H,10,12-16H2,1-2H3,(H,25,29)
InChIKeyONLCOKBWYRSIQG-UHFFFAOYSA-N
XLogP2.84
TPSA52.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.52
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(4-acetylpiperazin-1-yl)-N-(2-pyridin-2-ylethyl)indolizine-6-carboxamide
CID 97447978
3-(4-methylpiperidin-1-yl)-N-(2-pyridin-2-ylethyl)indolizine-6-carboxamide
CID 97407087
3-(4-acetylpiperazin-1-yl)-N-(pyridin-2-ylmethyl)indolizine-6-carboxamide
CID 97447967
3-(4-acetylpiperazin-1-yl)-N-(2-phenylethyl)indolizine-6-carboxamide
CID 97447966
3-(4-methylsulfonylpiperazin-1-yl)-N-(2-phenylethyl)indolizine-6-carboxamide
CID 97362437
4-(2-propan-2-yltetrazol-5-yl)-N-(2-pyridin-2-ylethyl)benzamide
CID 71707786
3-[(2R)-4-(cyclopropylmethyl)-1-propan-2-ylpiperazin-2-yl]-N-(2-pyridin-2-ylethyl)-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
CID 97448801
3-(4-methylpiperazin-1-yl)-N-(pyridin-4-ylmethyl)indolizine-6-carboxamide
CID 97447891
3-(1,4-dimethylpiperazin-2-yl)-N-(2-pyridin-2-ylethyl)-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
CID 131638547
ethane;2-methyl-N-(2-pyridin-2-ylethyl)propanamide
CID 142112887
N-[2-(3-fluorophenyl)ethyl]-3-(4-methylpiperidin-1-yl)indolizine-6-carboxamide
CID 97441664
4-propan-2-yl-N-(pyridin-2-ylmethyl)piperazine-1-carboxamide
CID 113103329

Frequently Asked Questions

What is the IUPAC name of 3-(4-propan-2-ylpiperazin-1-yl)-N-(2-pyridin-2-ylethyl)indolizine-6-carboxamide?
The IUPAC name of 3-(4-propan-2-ylpiperazin-1-yl)-N-(2-pyridin-2-ylethyl)indolizine-6-carboxamide (CID 97448096) is 3-(4-propan-2-ylpiperazin-1-yl)-N-(2-pyridin-2-ylethyl)indolizine-6-carboxamide.
What is the SMILES notation for 3-(4-propan-2-ylpiperazin-1-yl)-N-(2-pyridin-2-ylethyl)indolizine-6-carboxamide?
The canonical SMILES for 3-(4-propan-2-ylpiperazin-1-yl)-N-(2-pyridin-2-ylethyl)indolizine-6-carboxamide is CC(C)N1CCN(c2ccc3ccc(C(=O)NCCc4ccccn4)cn23)CC1.
What is the InChIKey of 3-(4-propan-2-ylpiperazin-1-yl)-N-(2-pyridin-2-ylethyl)indolizine-6-carboxamide?
The InChIKey is ONLCOKBWYRSIQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N5O/c1-18(2)26-13-15-27(16-14-26)22-9-8-21-7-6-19(17-28(21)22)23(29)25-12-10-20-5-3-4-11-24-20/h3-9,11,17-18H,10,12-16H2,1-2H3,(H,25,29).
What are the key properties of 3-(4-propan-2-ylpiperazin-1-yl)-N-(2-pyridin-2-ylethyl)indolizine-6-carboxamide?
3-(4-propan-2-ylpiperazin-1-yl)-N-(2-pyridin-2-ylethyl)indolizine-6-carboxamide has a molecular weight of 391.52 g/mol, XLogP of 2.84, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-propan-2-ylpiperazin-1-yl)-N-(2-pyridin-2-ylethyl)indolizine-6-carboxamide is sourced from PubChem (CID 97448096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).