6-methyl-5-(1-morpholin-4-ylethyl)-2-(1,3-thiazol-4-yl)indolizine-7-carboxylic acid

C19H21N3O3S — CID 138733421

IUPAC6-methyl-5-(1-morpholin-4-ylethyl)-2-(1,3-thiazol-4-yl)indolizine-7-carboxylic acid
SMILESCc1c(C(=O)O)cc2cc(-c3cscn3)cn2c1C(C)N1CCOCC1
InChIInChI=1S/C19H21N3O3S/c1-12-16(19(23)24)8-15-7-14(17-10-26-11-20-17)9-22(15)18(12)13(2)21-3-5-25-6-4-21/h7-11,13H,3-6H2,1-2H3,(H,23,24)
InChIKeyUFFDRBBJPPFFHL-UHFFFAOYSA-N
MW371.46 g/mol
LogP3.46
Rot. Bonds4

About 6-methyl-5-(1-morpholin-4-ylethyl)-2-(1,3-thiazol-4-yl)indolizine-7-carboxylic acid

6-methyl-5-(1-morpholin-4-ylethyl)-2-(1,3-thiazol-4-yl)indolizine-7-carboxylic acid (PubChem CID 138733421) has the molecular formula C19H21N3O3S and a molecular weight of 371.46 g/mol. Its IUPAC name is 6-methyl-5-(1-morpholin-4-ylethyl)-2-(1,3-thiazol-4-yl)indolizine-7-carboxylic acid.

Molecular Properties

Compound Name6-methyl-5-(1-morpholin-4-ylethyl)-2-(1,3-thiazol-4-yl)indolizine-7-carboxylic acid
PubChem CID138733421
Molecular FormulaC19H21N3O3S
Molecular Weight371.46 g/mol
Exact Mass371.13
IUPAC Name6-methyl-5-(1-morpholin-4-ylethyl)-2-(1,3-thiazol-4-yl)indolizine-7-carboxylic acid
SMILESCc1c(C(=O)O)cc2cc(-c3cscn3)cn2c1C(C)N1CCOCC1
InChIInChI=1S/C19H21N3O3S/c1-12-16(19(23)24)8-15-7-14(17-10-26-11-20-17)9-22(15)18(12)13(2)21-3-5-25-6-4-21/h7-11,13H,3-6H2,1-2H3,(H,23,24)
InChIKeyUFFDRBBJPPFFHL-UHFFFAOYSA-N
XLogP3.46
TPSA67.07 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.46
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-methyl-5-(1-morpholin-4-ylethyl)-2-(1,3-thiazol-4-yl)indolizine-7-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-Ethyl-5-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]indole-3-carboxylic acid
CID 156805892
1-ethyl-5-[4-[[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]methyl]-1,3-thiazol-2-yl]indole-3-carboxylic acid
CID 162650211
1-Ethyl-5-[4-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-1,3-thiazol-2-yl]indole-3-carboxylic acid
CID 162655329
3-(2-Isopropylthiazol-4-yl)indolizine-1-carboxylic acid
CID 118739015
6-Methyl-2-(1,3-thiazol-5-yl)-5-[1-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]ethyl]indolizine-7-carboxylic acid
CID 138733515
Propan-2-yl 6-methyl-2-(1,3-thiazol-5-yl)-5-[1-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]ethyl]indolizine-7-carboxylate
CID 138733554
6-Methyl-1-propan-2-yl-2-(1,3-thiazol-5-yl)-5-[1-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]ethyl]indolizine-7-carboxylic acid
CID 138733556
Propan-2-yl 6-methyl-2-(1,3-thiazol-5-yl)-5-[1-[4-(1,2,2-trifluoroethyl)piperazin-1-yl]ethyl]indolizine-7-carboxylate
CID 175336911
6-Methyl-2-(1,3-thiazol-5-yl)-5-[1-[4-(1,2,2-trifluoroethyl)piperazin-1-yl]ethyl]indolizine-7-carboxylic acid
CID 175337000
[3-(2-Ethyl-1,3-thiazol-4-yl)indolizin-1-yl]-morpholin-4-ylmethanone
CID 155901025
2-Methyl-5-[2-(6-methyl-3-pyridinyl)-1,3-thiazol-4-yl]-1-(oxolan-2-ylmethyl)pyrrole-3-carboxylic acid
CID 21893584
5-[2-(2-Ethyl-4-pyridinyl)-1,3-thiazol-4-yl]-2-methyl-1-(2-methylpropyl)pyrrole-3-carboxylic acid
CID 21893589

Frequently Asked Questions

What is the IUPAC name of 6-methyl-5-(1-morpholin-4-ylethyl)-2-(1,3-thiazol-4-yl)indolizine-7-carboxylic acid?
The IUPAC name of 6-methyl-5-(1-morpholin-4-ylethyl)-2-(1,3-thiazol-4-yl)indolizine-7-carboxylic acid (CID 138733421) is 6-methyl-5-(1-morpholin-4-ylethyl)-2-(1,3-thiazol-4-yl)indolizine-7-carboxylic acid.
What is the SMILES notation for 6-methyl-5-(1-morpholin-4-ylethyl)-2-(1,3-thiazol-4-yl)indolizine-7-carboxylic acid?
The canonical SMILES for 6-methyl-5-(1-morpholin-4-ylethyl)-2-(1,3-thiazol-4-yl)indolizine-7-carboxylic acid is Cc1c(C(=O)O)cc2cc(-c3cscn3)cn2c1C(C)N1CCOCC1.
What is the InChIKey of 6-methyl-5-(1-morpholin-4-ylethyl)-2-(1,3-thiazol-4-yl)indolizine-7-carboxylic acid?
The InChIKey is UFFDRBBJPPFFHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O3S/c1-12-16(19(23)24)8-15-7-14(17-10-26-11-20-17)9-22(15)18(12)13(2)21-3-5-25-6-4-21/h7-11,13H,3-6H2,1-2H3,(H,23,24).
What are the key properties of 6-methyl-5-(1-morpholin-4-ylethyl)-2-(1,3-thiazol-4-yl)indolizine-7-carboxylic acid?
6-methyl-5-(1-morpholin-4-ylethyl)-2-(1,3-thiazol-4-yl)indolizine-7-carboxylic acid has a molecular weight of 371.46 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-5-(1-morpholin-4-ylethyl)-2-(1,3-thiazol-4-yl)indolizine-7-carboxylic acid is sourced from PubChem (CID 138733421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).