methanol;6-methyl-5-(1-morpholin-4-ylethyl)-1-phenylindolizine-7-carbaldehyde

C23H28N2O3 — CID 142300594

IUPACmethanol;6-methyl-5-(1-morpholin-4-ylethyl)-1-phenylindolizine-7-carbaldehyde
SMILESCO.Cc1c(C=O)cc2c(-c3ccccc3)ccn2c1C(C)N1CCOCC1
InChIInChI=1S/C22H24N2O2.CH4O/c1-16-19(15-25)14-21-20(18-6-4-3-5-7-18)8-9-24(21)22(16)17(2)23-10-12-26-13-11-23;1-2/h3-9,14-15,17H,10-13H2,1-2H3;2H,1H3
InChIKeyFLLQRRHQDMPCBS-UHFFFAOYSA-N
MW380.49 g/mol
LogP3.73
Rot. Bonds4

About methanol;6-methyl-5-(1-morpholin-4-ylethyl)-1-phenylindolizine-7-carbaldehyde

methanol;6-methyl-5-(1-morpholin-4-ylethyl)-1-phenylindolizine-7-carbaldehyde (PubChem CID 142300594) has the molecular formula C23H28N2O3 and a molecular weight of 380.49 g/mol. Its IUPAC name is methanol;6-methyl-5-(1-morpholin-4-ylethyl)-1-phenylindolizine-7-carbaldehyde.

Molecular Properties

Compound Namemethanol;6-methyl-5-(1-morpholin-4-ylethyl)-1-phenylindolizine-7-carbaldehyde
PubChem CID142300594
Molecular FormulaC23H28N2O3
Molecular Weight380.49 g/mol
Exact Mass380.21
IUPAC Namemethanol;6-methyl-5-(1-morpholin-4-ylethyl)-1-phenylindolizine-7-carbaldehyde
SMILESCO.Cc1c(C=O)cc2c(-c3ccccc3)ccn2c1C(C)N1CCOCC1
InChIInChI=1S/C22H24N2O2.CH4O/c1-16-19(15-25)14-21-20(18-6-4-3-5-7-18)8-9-24(21)22(16)17(2)23-10-12-26-13-11-23;1-2/h3-9,14-15,17H,10-13H2,1-2H3;2H,1H3
InChIKeyFLLQRRHQDMPCBS-UHFFFAOYSA-N
XLogP3.73
TPSA54.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.49
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

propan-2-yl 6-methyl-5-(1-morpholin-4-ylethyl)-1-phenylindolizine-7-carboxylate
CID 139311524
1-(3,4-dimethylphenyl)-6-methyl-5-(1-morpholin-4-ylethyl)indolizine-7-carboxylic acid
CID 142300446
2-(1-morpholin-4-ylethyl)benzaldehyde
CID 105474307
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1-(3,5-dimethylphenyl)-6-methyl-5-(1-morpholin-4-ylethyl)indolizine-7-carboxamide
CID 138733657
6-methyl-5-(1-morpholin-4-ylethyl)-2-pyridin-3-ylindolizine-7-carboxylic acid
CID 139311468
6-methyl-1-(2-methylpyrimidin-5-yl)-5-[1-[4-(1,2,2-trifluoroethyl)piperazin-1-yl]ethyl]indolizine-7-carboxylic acid
CID 175336965
(2R)-2-morpholin-4-yl-N-(2-phenylphenyl)propanamide
CID 1429478
7,16-bis[(1R)-1-phenylethyl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane
CID 12990897
4-(1-phenylethyl)morpholine;hydrochloride
CID 3057369
4-[1-[7-ethenyl-6-methyl-2-(2-methylpyrazol-3-yl)indolizin-5-yl]ethyl]morpholine
CID 142300874
6-methyl-1-(2-propan-2-yl-4-pyridinyl)-5-[1-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]ethyl]indolizine-7-carboxylic acid
CID 134340752
ethane;2-methyl-5-(1-morpholin-4-ylethyl)benzaldehyde;N-methyloxan-4-amine
CID 143797023

Frequently Asked Questions

What is the IUPAC name of methanol;6-methyl-5-(1-morpholin-4-ylethyl)-1-phenylindolizine-7-carbaldehyde?
The IUPAC name of methanol;6-methyl-5-(1-morpholin-4-ylethyl)-1-phenylindolizine-7-carbaldehyde (CID 142300594) is methanol;6-methyl-5-(1-morpholin-4-ylethyl)-1-phenylindolizine-7-carbaldehyde.
What is the SMILES notation for methanol;6-methyl-5-(1-morpholin-4-ylethyl)-1-phenylindolizine-7-carbaldehyde?
The canonical SMILES for methanol;6-methyl-5-(1-morpholin-4-ylethyl)-1-phenylindolizine-7-carbaldehyde is CO.Cc1c(C=O)cc2c(-c3ccccc3)ccn2c1C(C)N1CCOCC1.
What is the InChIKey of methanol;6-methyl-5-(1-morpholin-4-ylethyl)-1-phenylindolizine-7-carbaldehyde?
The InChIKey is FLLQRRHQDMPCBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O2.CH4O/c1-16-19(15-25)14-21-20(18-6-4-3-5-7-18)8-9-24(21)22(16)17(2)23-10-12-26-13-11-23;1-2/h3-9,14-15,17H,10-13H2,1-2H3;2H,1H3.
What are the key properties of methanol;6-methyl-5-(1-morpholin-4-ylethyl)-1-phenylindolizine-7-carbaldehyde?
methanol;6-methyl-5-(1-morpholin-4-ylethyl)-1-phenylindolizine-7-carbaldehyde has a molecular weight of 380.49 g/mol, XLogP of 3.73, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;6-methyl-5-(1-morpholin-4-ylethyl)-1-phenylindolizine-7-carbaldehyde is sourced from PubChem (CID 142300594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).