1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-methyl-N-(1-methylpiperidin-4-yl)cyclopropane-1-carboxamide

C18H23N3O3 — CID 90502780

IUPAC1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-methyl-N-(1-methylpiperidin-4-yl)cyclopropane-1-carboxamide
SMILESCN1CCC(N(C)C(=O)C2(c3cc(-c4ccco4)on3)CC2)CC1
InChIInChI=1S/C18H23N3O3/c1-20-9-5-13(6-10-20)21(2)17(22)18(7-8-18)16-12-15(24-19-16)14-4-3-11-23-14/h3-4,11-13H,5-10H2,1-2H3
InChIKeyJJVDBPXUEQEQJW-UHFFFAOYSA-N
MW329.40 g/mol
LogP2.52
Rot. Bonds4

About 1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-methyl-N-(1-methylpiperidin-4-yl)cyclopropane-1-carboxamide

1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-methyl-N-(1-methylpiperidin-4-yl)cyclopropane-1-carboxamide (PubChem CID 90502780) has the molecular formula C18H23N3O3 and a molecular weight of 329.40 g/mol. Its IUPAC name is 1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-methyl-N-(1-methylpiperidin-4-yl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-methyl-N-(1-methylpiperidin-4-yl)cyclopropane-1-carboxamide
PubChem CID90502780
Molecular FormulaC18H23N3O3
Molecular Weight329.40 g/mol
Exact Mass329.17
IUPAC Name1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-methyl-N-(1-methylpiperidin-4-yl)cyclopropane-1-carboxamide
SMILESCN1CCC(N(C)C(=O)C2(c3cc(-c4ccco4)on3)CC2)CC1
InChIInChI=1S/C18H23N3O3/c1-20-9-5-13(6-10-20)21(2)17(22)18(7-8-18)16-12-15(24-19-16)14-4-3-11-23-14/h3-4,11-13H,5-10H2,1-2H3
InChIKeyJJVDBPXUEQEQJW-UHFFFAOYSA-N
XLogP2.52
TPSA62.72 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-methyl-N-(1-methylpiperidin-4-yl)cyclopropane-1-carboxamide with MolForge

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Related Compounds

[1-[5-(furan-2-yl)-1,2-oxazol-3-yl]cyclopropyl]-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 90503029
N-(3-acetamidophenyl)-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]cyclopropane-1-carboxamide
CID 90502897
N-(2,3-dimethylphenyl)-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]cyclopropane-1-carboxamide
CID 90502927
1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-octylcyclopropane-1-carboxamide
CID 90502974
1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-(4-morpholin-4-ylphenyl)cyclopropane-1-carboxamide
CID 90503022
[1-[5-(furan-2-yl)-1,2-oxazol-3-yl]cyclopropyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone
CID 90502995
1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-[2-(2-methylimidazol-1-yl)ethyl]cyclopropane-1-carboxamide
CID 90502761
methyl 2-[[1-[5-(furan-2-yl)-1,2-oxazol-3-yl]cyclopropanecarbonyl]amino]thiophene-3-carboxylate
CID 90503043
2-(furan-2-yl)-N-methyl-N-(1-methylpiperidin-4-yl)quinoline-4-carboxamide
CID 2390768
[5-(furan-2-yl)-1,2-oxazol-3-yl]-[4-(4-methylpiperazine-1-carbonyl)piperazin-1-yl]methanone
CID 167750688
(4-amino-3,3-dimethylpiperidin-1-yl)-[5-(furan-2-yl)-1,2-oxazol-3-yl]methanone;hydrochloride
CID 120818638
N-(3,4-dimethylcyclohexyl)-N-(4,4-dimethylcyclohexyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 71305023

Frequently Asked Questions

What is the IUPAC name of 1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-methyl-N-(1-methylpiperidin-4-yl)cyclopropane-1-carboxamide?
The IUPAC name of 1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-methyl-N-(1-methylpiperidin-4-yl)cyclopropane-1-carboxamide (CID 90502780) is 1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-methyl-N-(1-methylpiperidin-4-yl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-methyl-N-(1-methylpiperidin-4-yl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-methyl-N-(1-methylpiperidin-4-yl)cyclopropane-1-carboxamide is CN1CCC(N(C)C(=O)C2(c3cc(-c4ccco4)on3)CC2)CC1.
What is the InChIKey of 1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-methyl-N-(1-methylpiperidin-4-yl)cyclopropane-1-carboxamide?
The InChIKey is JJVDBPXUEQEQJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O3/c1-20-9-5-13(6-10-20)21(2)17(22)18(7-8-18)16-12-15(24-19-16)14-4-3-11-23-14/h3-4,11-13H,5-10H2,1-2H3.
What are the key properties of 1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-methyl-N-(1-methylpiperidin-4-yl)cyclopropane-1-carboxamide?
1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-methyl-N-(1-methylpiperidin-4-yl)cyclopropane-1-carboxamide has a molecular weight of 329.40 g/mol, XLogP of 2.52, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-methyl-N-(1-methylpiperidin-4-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 90502780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).