methyl 7-(morpholine-4-carbonyl)-2-phenyl-5H-indeno[1,2-b]pyridine-4-carboxylate

C25H22N2O4 — CID 148593783

IUPACmethyl 7-(morpholine-4-carbonyl)-2-phenyl-5H-indeno[1,2-b]pyridine-4-carboxylate
SMILESCOC(=O)c1cc(-c2ccccc2)nc2c1Cc1cc(C(=O)N3CCOCC3)ccc1-2
InChIInChI=1S/C25H22N2O4/c1-30-25(29)21-15-22(16-5-3-2-4-6-16)26-23-19-8-7-17(13-18(19)14-20(21)23)24(28)27-9-11-31-12-10-27/h2-8,13,15H,9-12,14H2,1H3
InChIKeyNBDXHAVWYHBXOW-UHFFFAOYSA-N
MW414.46 g/mol
LogP3.58
Rot. Bonds3

About methyl 7-(morpholine-4-carbonyl)-2-phenyl-5H-indeno[1,2-b]pyridine-4-carboxylate

methyl 7-(morpholine-4-carbonyl)-2-phenyl-5H-indeno[1,2-b]pyridine-4-carboxylate (PubChem CID 148593783) has the molecular formula C25H22N2O4 and a molecular weight of 414.46 g/mol. Its IUPAC name is methyl 7-(morpholine-4-carbonyl)-2-phenyl-5H-indeno[1,2-b]pyridine-4-carboxylate.

Molecular Properties

Compound Namemethyl 7-(morpholine-4-carbonyl)-2-phenyl-5H-indeno[1,2-b]pyridine-4-carboxylate
PubChem CID148593783
Molecular FormulaC25H22N2O4
Molecular Weight414.46 g/mol
Exact Mass414.16
IUPAC Namemethyl 7-(morpholine-4-carbonyl)-2-phenyl-5H-indeno[1,2-b]pyridine-4-carboxylate
SMILESCOC(=O)c1cc(-c2ccccc2)nc2c1Cc1cc(C(=O)N3CCOCC3)ccc1-2
InChIInChI=1S/C25H22N2O4/c1-30-25(29)21-15-22(16-5-3-2-4-6-16)26-23-19-8-7-17(13-18(19)14-20(21)23)24(28)27-9-11-31-12-10-27/h2-8,13,15H,9-12,14H2,1H3
InChIKeyNBDXHAVWYHBXOW-UHFFFAOYSA-N
XLogP3.58
TPSA68.73 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.46
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze methyl 7-(morpholine-4-carbonyl)-2-phenyl-5H-indeno[1,2-b]pyridine-4-carboxylate 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

7-[4-(cyclopropylmethyl)piperazine-1-carbonyl]-2-phenyl-5H-indeno[1,2-b]pyridine-4-carboxamide
CID 158118957
[3-(4-methylphenyl)-6-phenyl-[1,2]oxazolo[5,4-b]pyridin-4-yl]-morpholin-4-ylmethanone
CID 171315340
3-(2-methyl-1,3-thiazol-4-yl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide
CID 152964048
methyl 2-(3-phenyl-5,6,7,8-tetrahydroisoquinolin-1-yl)benzoate
CID 101387373
3-methyl-N-[3-(morpholine-4-carbonyl)phenyl]-6-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 55797229
[2-(3,4-dimethoxyphenyl)-6-phenyl-3-pyridinyl]-morpholin-4-ylmethanone
CID 19005849
(4-chloro-3-phenylphenyl)-morpholin-4-ylmethanone
CID 110675198
methyl 2-(carbamothioylamino)-4-(morpholine-4-carbonyl)benzoate
CID 169358231
7-(morpholine-4-carbonyl)-3-(2-phenylmethoxypyrimidin-5-yl)-9H-fluorene-1-carboxamide
CID 148746011
[3-amino-4-(4-methoxyphenyl)-6-phenylthieno[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone
CID 1147313
methyl 5-amino-1-[4-(morpholine-4-carbonyl)phenyl]pyrazole-4-carboxylate
CID 46363474
N-[2-methoxy-5-(morpholine-4-carbonyl)phenyl]-2-methylbenzamide
CID 50875897

Frequently Asked Questions

What is the IUPAC name of methyl 7-(morpholine-4-carbonyl)-2-phenyl-5H-indeno[1,2-b]pyridine-4-carboxylate?
The IUPAC name of methyl 7-(morpholine-4-carbonyl)-2-phenyl-5H-indeno[1,2-b]pyridine-4-carboxylate (CID 148593783) is methyl 7-(morpholine-4-carbonyl)-2-phenyl-5H-indeno[1,2-b]pyridine-4-carboxylate.
What is the SMILES notation for methyl 7-(morpholine-4-carbonyl)-2-phenyl-5H-indeno[1,2-b]pyridine-4-carboxylate?
The canonical SMILES for methyl 7-(morpholine-4-carbonyl)-2-phenyl-5H-indeno[1,2-b]pyridine-4-carboxylate is COC(=O)c1cc(-c2ccccc2)nc2c1Cc1cc(C(=O)N3CCOCC3)ccc1-2.
What is the InChIKey of methyl 7-(morpholine-4-carbonyl)-2-phenyl-5H-indeno[1,2-b]pyridine-4-carboxylate?
The InChIKey is NBDXHAVWYHBXOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22N2O4/c1-30-25(29)21-15-22(16-5-3-2-4-6-16)26-23-19-8-7-17(13-18(19)14-20(21)23)24(28)27-9-11-31-12-10-27/h2-8,13,15H,9-12,14H2,1H3.
What are the key properties of methyl 7-(morpholine-4-carbonyl)-2-phenyl-5H-indeno[1,2-b]pyridine-4-carboxylate?
methyl 7-(morpholine-4-carbonyl)-2-phenyl-5H-indeno[1,2-b]pyridine-4-carboxylate has a molecular weight of 414.46 g/mol, XLogP of 3.58, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 7-(morpholine-4-carbonyl)-2-phenyl-5H-indeno[1,2-b]pyridine-4-carboxylate is sourced from PubChem (CID 148593783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).