morpholin-4-yl-[1-(3-pyridin-3-ylbenzoyl)pyrrolidin-2-yl]methanone

C21H23N3O3 — CID 134801928

IUPACmorpholin-4-yl-[1-(3-pyridin-3-ylbenzoyl)pyrrolidin-2-yl]methanone
SMILESO=C(C1CCCN1C(=O)c1cccc(-c2cccnc2)c1)N1CCOCC1
InChIInChI=1S/C21H23N3O3/c25-20(17-5-1-4-16(14-17)18-6-2-8-22-15-18)24-9-3-7-19(24)21(26)23-10-12-27-13-11-23/h1-2,4-6,8,14-15,19H,3,7,9-13H2
InChIKeyVHMGFWSHNGRHQZ-UHFFFAOYSA-N
MW365.43 g/mol
LogP2.21
Rot. Bonds3

About morpholin-4-yl-[1-(3-pyridin-3-ylbenzoyl)pyrrolidin-2-yl]methanone

morpholin-4-yl-[1-(3-pyridin-3-ylbenzoyl)pyrrolidin-2-yl]methanone (PubChem CID 134801928) has the molecular formula C21H23N3O3 and a molecular weight of 365.43 g/mol. Its IUPAC name is morpholin-4-yl-[1-(3-pyridin-3-ylbenzoyl)pyrrolidin-2-yl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[1-(3-pyridin-3-ylbenzoyl)pyrrolidin-2-yl]methanone
PubChem CID134801928
Molecular FormulaC21H23N3O3
Molecular Weight365.43 g/mol
Exact Mass365.17
IUPAC Namemorpholin-4-yl-[1-(3-pyridin-3-ylbenzoyl)pyrrolidin-2-yl]methanone
SMILESO=C(C1CCCN1C(=O)c1cccc(-c2cccnc2)c1)N1CCOCC1
InChIInChI=1S/C21H23N3O3/c25-20(17-5-1-4-16(14-17)18-6-2-8-22-15-18)24-9-3-7-19(24)21(26)23-10-12-27-13-11-23/h1-2,4-6,8,14-15,19H,3,7,9-13H2
InChIKeyVHMGFWSHNGRHQZ-UHFFFAOYSA-N
XLogP2.21
TPSA62.74 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.43
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze morpholin-4-yl-[1-(3-pyridin-3-ylbenzoyl)pyrrolidin-2-yl]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

[(2S)-1-(3-fluorobenzoyl)pyrrolidin-2-yl]-morpholin-4-ylmethanone
CID 110285997
N-(cyclopropylmethyl)-1-(3-pyridin-3-ylbenzoyl)pyrrolidine-2-carboxamide
CID 134803506
N-(2-cyclohexylethyl)-1-(3-pyridin-3-ylbenzoyl)pyrrolidine-2-carboxamide
CID 134801025
2-methyl-N-[3-[(2S)-2-(morpholine-4-carbonyl)pyrrolidine-1-carbonyl]phenyl]propanamide
CID 131894338
N-[(3-chlorophenyl)methyl]-1-(3-pyridin-3-ylbenzoyl)pyrrolidine-2-carboxamide
CID 134803976
(4-methylpiperidin-1-yl)-[1-(pyridine-3-carbonyl)piperidin-2-yl]methanone
CID 119032862
[1-(furan-3-carbonyl)piperidin-2-yl]-morpholin-4-ylmethanone
CID 4089666
[(3aS,6aR)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-[(2R)-1-(pyridine-3-carbonyl)piperidin-2-yl]methanone
CID 97078426
[(2S)-1-(isoquinoline-1-carbonyl)pyrrolidin-2-yl]-morpholin-4-ylmethanone
CID 95619677
[(2S,4S)-1-(3-methylbenzoyl)-4-pyridin-3-yloxypyrrolidin-2-yl]-morpholin-4-ylmethanone
CID 110198632
[1-(3,4-dichlorobenzoyl)pyrrolidin-2-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone
CID 112820287
[4-benzyl-1-(pyridine-3-carbonyl)piperazin-2-yl]-morpholin-4-ylmethanone
CID 24730509

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[1-(3-pyridin-3-ylbenzoyl)pyrrolidin-2-yl]methanone?
The IUPAC name of morpholin-4-yl-[1-(3-pyridin-3-ylbenzoyl)pyrrolidin-2-yl]methanone (CID 134801928) is morpholin-4-yl-[1-(3-pyridin-3-ylbenzoyl)pyrrolidin-2-yl]methanone.
What is the SMILES notation for morpholin-4-yl-[1-(3-pyridin-3-ylbenzoyl)pyrrolidin-2-yl]methanone?
The canonical SMILES for morpholin-4-yl-[1-(3-pyridin-3-ylbenzoyl)pyrrolidin-2-yl]methanone is O=C(C1CCCN1C(=O)c1cccc(-c2cccnc2)c1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-[1-(3-pyridin-3-ylbenzoyl)pyrrolidin-2-yl]methanone?
The InChIKey is VHMGFWSHNGRHQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O3/c25-20(17-5-1-4-16(14-17)18-6-2-8-22-15-18)24-9-3-7-19(24)21(26)23-10-12-27-13-11-23/h1-2,4-6,8,14-15,19H,3,7,9-13H2.
What are the key properties of morpholin-4-yl-[1-(3-pyridin-3-ylbenzoyl)pyrrolidin-2-yl]methanone?
morpholin-4-yl-[1-(3-pyridin-3-ylbenzoyl)pyrrolidin-2-yl]methanone has a molecular weight of 365.43 g/mol, XLogP of 2.21, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[1-(3-pyridin-3-ylbenzoyl)pyrrolidin-2-yl]methanone is sourced from PubChem (CID 134801928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).