N-[[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-propylpyrrolidin-3-amine

C14H20N4O2 — CID 63300902

IUPACN-[[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-propylpyrrolidin-3-amine
SMILESCCCN(Cc1noc(-c2ccco2)n1)C1CCNC1
InChIInChI=1S/C14H20N4O2/c1-2-7-18(11-5-6-15-9-11)10-13-16-14(20-17-13)12-4-3-8-19-12/h3-4,8,11,15H,2,5-7,9-10H2,1H3
InChIKeyUKGORGPTXTZIMT-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.90
Rot. Bonds6

About N-[[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-propylpyrrolidin-3-amine

N-[[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-propylpyrrolidin-3-amine (PubChem CID 63300902) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-[[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-propylpyrrolidin-3-amine.

Molecular Properties

Compound NameN-[[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-propylpyrrolidin-3-amine
PubChem CID63300902
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC NameN-[[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-propylpyrrolidin-3-amine
SMILESCCCN(Cc1noc(-c2ccco2)n1)C1CCNC1
InChIInChI=1S/C14H20N4O2/c1-2-7-18(11-5-6-15-9-11)10-13-16-14(20-17-13)12-4-3-8-19-12/h3-4,8,11,15H,2,5-7,9-10H2,1H3
InChIKeyUKGORGPTXTZIMT-UHFFFAOYSA-N
XLogP1.90
TPSA67.33 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-methylpyrrolidin-3-amine
CID 63301501
N-propyl-N-[(5-propyl-1,2,4-oxadiazol-3-yl)methyl]pyrrolidin-3-amine
CID 63304349
N-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-N-propylazetidin-3-amine
CID 66215112
N-propyl-N-[(5-thiophen-2-yl-1,2,4-oxadiazol-3-yl)methyl]azetidin-3-amine
CID 66213913
N-propyl-N-[(5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl]azetidin-3-amine
CID 66215907
2-[ethyl-[[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]methyl]amino]ethanol
CID 62020296
N-benzyl-N-propylpyrrolidin-3-amine;hydrochloride
CID 119921759
N-[[2-(3-fluorophenyl)-1,3-oxazol-4-yl]methyl]-N-propylpyrrolidin-3-amine;hydrochloride
CID 119921783
N-[(2-ethylphenyl)methyl]-N-propylpyrrolidin-3-amine
CID 63300786
2-(furan-2-yl)-5-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide
CID 119530777
N-[(2,6-dichlorophenyl)methyl]-N-propylpyrrolidin-3-amine
CID 55204961
N-[(4-methylphenyl)methyl]-N-propylpyrrolidin-3-amine
CID 63300569

Frequently Asked Questions

What is the IUPAC name of N-[[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-propylpyrrolidin-3-amine?
The IUPAC name of N-[[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-propylpyrrolidin-3-amine (CID 63300902) is N-[[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-propylpyrrolidin-3-amine.
What is the SMILES notation for N-[[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-propylpyrrolidin-3-amine?
The canonical SMILES for N-[[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-propylpyrrolidin-3-amine is CCCN(Cc1noc(-c2ccco2)n1)C1CCNC1.
What is the InChIKey of N-[[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-propylpyrrolidin-3-amine?
The InChIKey is UKGORGPTXTZIMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-2-7-18(11-5-6-15-9-11)10-13-16-14(20-17-13)12-4-3-8-19-12/h3-4,8,11,15H,2,5-7,9-10H2,1H3.
What are the key properties of N-[[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-propylpyrrolidin-3-amine?
N-[[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-propylpyrrolidin-3-amine has a molecular weight of 276.34 g/mol, XLogP of 1.90, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-propylpyrrolidin-3-amine is sourced from PubChem (CID 63300902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).