(3-cyclopropyl-3-methylmorpholin-4-yl)-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]methanone

C19H25N3O3 — CID 136567866

IUPAC(3-cyclopropyl-3-methylmorpholin-4-yl)-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]methanone
SMILESCc1cc(-n2c(C)cc(C(=O)N3CCOCC3(C)C3CC3)c2C)no1
InChIInChI=1S/C19H25N3O3/c1-12-9-16(14(3)22(12)17-10-13(2)25-20-17)18(23)21-7-8-24-11-19(21,4)15-5-6-15/h9-10,15H,5-8,11H2,1-4H3
InChIKeyFNBFPQPDLHMNSY-UHFFFAOYSA-N
MW343.43 g/mol
LogP3.03
Rot. Bonds3

About (3-cyclopropyl-3-methylmorpholin-4-yl)-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]methanone

(3-cyclopropyl-3-methylmorpholin-4-yl)-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]methanone (PubChem CID 136567866) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is (3-cyclopropyl-3-methylmorpholin-4-yl)-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]methanone.

Molecular Properties

Compound Name(3-cyclopropyl-3-methylmorpholin-4-yl)-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]methanone
PubChem CID136567866
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC Name(3-cyclopropyl-3-methylmorpholin-4-yl)-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]methanone
SMILESCc1cc(-n2c(C)cc(C(=O)N3CCOCC3(C)C3CC3)c2C)no1
InChIInChI=1S/C19H25N3O3/c1-12-9-16(14(3)22(12)17-10-13(2)25-20-17)18(23)21-7-8-24-11-19(21,4)15-5-6-15/h9-10,15H,5-8,11H2,1-4H3
InChIKeyFNBFPQPDLHMNSY-UHFFFAOYSA-N
XLogP3.03
TPSA60.50 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Launch Full Analysis

Related Compounds

[3-(aminomethyl)pyrrolidin-1-yl]-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]methanone
CID 119485066
[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone;hydrochloride
CID 119650194
[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]-[3-(methylamino)piperidin-1-yl]methanone;hydrochloride
CID 119490318
[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]-(4-methyl-1,4-diazepan-1-yl)methanone
CID 78835942
[3,3-bis(trifluoromethyl)pyrrolidin-1-yl]-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]methanone
CID 99808864
1-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrole-3-carbonyl]-5-methylpiperidine-3-carboxylic acid
CID 122119078
1-[4-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrole-3-carbonyl]piperazin-1-yl]-2-methoxyethanone
CID 78882569
N-cyclohexyl-N,2,5-trimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrole-3-carboxamide
CID 86921369
1-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]-2-(3-hydroxy-3-methylpyrrolidin-1-yl)ethanone
CID 136512574
(2S)-1-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrole-3-carbonyl]-N-phenylpyrrolidine-2-carboxamide
CID 30890128
N-(5-chloro-2-morpholin-4-ylphenyl)-2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrole-3-carboxamide
CID 78836494
2,5-dimethyl-N-(2-methyl-3-morpholin-4-ylpropyl)-1-(5-methyl-1,2-oxazol-3-yl)pyrrole-3-carboxamide
CID 136527092

Frequently Asked Questions

What is the IUPAC name of (3-cyclopropyl-3-methylmorpholin-4-yl)-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]methanone?
The IUPAC name of (3-cyclopropyl-3-methylmorpholin-4-yl)-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]methanone (CID 136567866) is (3-cyclopropyl-3-methylmorpholin-4-yl)-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]methanone.
What is the SMILES notation for (3-cyclopropyl-3-methylmorpholin-4-yl)-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]methanone?
The canonical SMILES for (3-cyclopropyl-3-methylmorpholin-4-yl)-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]methanone is Cc1cc(-n2c(C)cc(C(=O)N3CCOCC3(C)C3CC3)c2C)no1.
What is the InChIKey of (3-cyclopropyl-3-methylmorpholin-4-yl)-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]methanone?
The InChIKey is FNBFPQPDLHMNSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-12-9-16(14(3)22(12)17-10-13(2)25-20-17)18(23)21-7-8-24-11-19(21,4)15-5-6-15/h9-10,15H,5-8,11H2,1-4H3.
What are the key properties of (3-cyclopropyl-3-methylmorpholin-4-yl)-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]methanone?
(3-cyclopropyl-3-methylmorpholin-4-yl)-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]methanone has a molecular weight of 343.43 g/mol, XLogP of 3.03, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyclopropyl-3-methylmorpholin-4-yl)-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]methanone is sourced from PubChem (CID 136567866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).