morpholin-4-yl-[6-[2-(2-pyrrolidin-1-ylethyl)-1-benzofuran-5-yl]-3-pyridinyl]methanone

C24H27N3O3 — CID 22274481

IUPACmorpholin-4-yl-[6-[2-(2-pyrrolidin-1-ylethyl)-1-benzofuran-5-yl]-3-pyridinyl]methanone
SMILESO=C(c1ccc(-c2ccc3oc(CCN4CCCC4)cc3c2)nc1)N1CCOCC1
InChIInChI=1S/C24H27N3O3/c28-24(27-11-13-29-14-12-27)19-3-5-22(25-17-19)18-4-6-23-20(15-18)16-21(30-23)7-10-26-8-1-2-9-26/h3-6,15-17H,1-2,7-14H2
InChIKeyRRLCACGGDHPKNQ-UHFFFAOYSA-N
MW405.50 g/mol
LogP3.61
Rot. Bonds5

About morpholin-4-yl-[6-[2-(2-pyrrolidin-1-ylethyl)-1-benzofuran-5-yl]-3-pyridinyl]methanone

morpholin-4-yl-[6-[2-(2-pyrrolidin-1-ylethyl)-1-benzofuran-5-yl]-3-pyridinyl]methanone (PubChem CID 22274481) has the molecular formula C24H27N3O3 and a molecular weight of 405.50 g/mol. Its IUPAC name is morpholin-4-yl-[6-[2-(2-pyrrolidin-1-ylethyl)-1-benzofuran-5-yl]-3-pyridinyl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[6-[2-(2-pyrrolidin-1-ylethyl)-1-benzofuran-5-yl]-3-pyridinyl]methanone
PubChem CID22274481
Molecular FormulaC24H27N3O3
Molecular Weight405.50 g/mol
Exact Mass405.21
IUPAC Namemorpholin-4-yl-[6-[2-(2-pyrrolidin-1-ylethyl)-1-benzofuran-5-yl]-3-pyridinyl]methanone
SMILESO=C(c1ccc(-c2ccc3oc(CCN4CCCC4)cc3c2)nc1)N1CCOCC1
InChIInChI=1S/C24H27N3O3/c28-24(27-11-13-29-14-12-27)19-3-5-22(25-17-19)18-4-6-23-20(15-18)16-21(30-23)7-10-26-8-1-2-9-26/h3-6,15-17H,1-2,7-14H2
InChIKeyRRLCACGGDHPKNQ-UHFFFAOYSA-N
XLogP3.61
TPSA58.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.50
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze morpholin-4-yl-[6-[2-(2-pyrrolidin-1-ylethyl)-1-benzofuran-5-yl]-3-pyridinyl]methanone 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

2-[2-(4-fluoro-2-methylphenoxymethyl)-5-methoxypyridin-4-yl]-1H,4H,5H,6H,7H-pyrrolo[3,2-c]pyridin-4-one
CID 71461150
4-{[6-(2-{2-[(2R)-methylpyrrolidinyl]ethyl}-1-benzofuran-5-yl)-3-pyridinyl]carbonyl}morpholine
CID 44374493
3-(2,3-Dihydro-benzofuran-5-yl)-2-(5-pyridin-3-yl-furan-2-carbonyl)-1,2,3,4-tetrahydro-pyrrolo[3,4-b]quinolin-9-one
CID 11754694
(-)-Dimethyl-{2-[3-((R)-1-pyridin-2-yl-ethyl)-benzofuran-2-yl]-ethyl}-amine
CID 44247935
3-Benzofuran-2-yl-5-((S)-1-methyl-pyrrolidin-2-ylmethoxy)-pyridine
CID 44371989
1-((6-(5-Cyclohexylbenzofuran-2-yl)pyridin-3-yl)methyl)azetidine-3-carboxylic acid
CID 16737509
4-[(6-{2-[2-(4-Methyl-1-piperidinyl)ethyl]-1-benzofuran-5-yl}-3-pyridinyl)carbonyl]morpholine
CID 22274462
4-[(6-{2-[2-(1-Piperidinyl)ethyl]-1-benzofuran-5-yl}-3-pyridinyl)carbonyl]morpholine
CID 22274469
4-{[6-(2-{2-[1-Azepanyl]ethyl}-1-benzofuran-5-yl)-3-pyridinyl]carbonyl}morpholine
CID 22274472
4-[(6-{2-[2-(4-Morpholinyl)ethyl]-1-benzofuran-5-yl}-3-pyridinyl)carbonyl]morpholine
CID 22274699
Methyl 6-(2-(3-(4-phenoxyphenyl)propanoyl)oxazol-5-yl)pyridine-3-carboxylate
CID 24800000
(6-{2-[2-((2R,5R)-2,5-Dimethyl-pyrrolidin-1-yl)-ethyl]-benzofuran-5-yl}-pyridin-3-yl)-morpholin-4-yl-methanone
CID 44374695

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[6-[2-(2-pyrrolidin-1-ylethyl)-1-benzofuran-5-yl]-3-pyridinyl]methanone?
The IUPAC name of morpholin-4-yl-[6-[2-(2-pyrrolidin-1-ylethyl)-1-benzofuran-5-yl]-3-pyridinyl]methanone (CID 22274481) is morpholin-4-yl-[6-[2-(2-pyrrolidin-1-ylethyl)-1-benzofuran-5-yl]-3-pyridinyl]methanone.
What is the SMILES notation for morpholin-4-yl-[6-[2-(2-pyrrolidin-1-ylethyl)-1-benzofuran-5-yl]-3-pyridinyl]methanone?
The canonical SMILES for morpholin-4-yl-[6-[2-(2-pyrrolidin-1-ylethyl)-1-benzofuran-5-yl]-3-pyridinyl]methanone is O=C(c1ccc(-c2ccc3oc(CCN4CCCC4)cc3c2)nc1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-[6-[2-(2-pyrrolidin-1-ylethyl)-1-benzofuran-5-yl]-3-pyridinyl]methanone?
The InChIKey is RRLCACGGDHPKNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O3/c28-24(27-11-13-29-14-12-27)19-3-5-22(25-17-19)18-4-6-23-20(15-18)16-21(30-23)7-10-26-8-1-2-9-26/h3-6,15-17H,1-2,7-14H2.
What are the key properties of morpholin-4-yl-[6-[2-(2-pyrrolidin-1-ylethyl)-1-benzofuran-5-yl]-3-pyridinyl]methanone?
morpholin-4-yl-[6-[2-(2-pyrrolidin-1-ylethyl)-1-benzofuran-5-yl]-3-pyridinyl]methanone has a molecular weight of 405.50 g/mol, XLogP of 3.61, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[6-[2-(2-pyrrolidin-1-ylethyl)-1-benzofuran-5-yl]-3-pyridinyl]methanone is sourced from PubChem (CID 22274481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).