N-[1-(furan-2-yl)propyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine

C14H22N2O — CID 62632367

IUPACN-[1-(furan-2-yl)propyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
SMILESCCC(NC1CCN2CCCC12)c1ccco1
InChIInChI=1S/C14H22N2O/c1-2-11(14-6-4-10-17-14)15-12-7-9-16-8-3-5-13(12)16/h4,6,10-13,15H,2-3,5,7-9H2,1H3
InChIKeyVXZODGYPEYYSBR-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.56
Rot. Bonds4

About N-[1-(furan-2-yl)propyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine

N-[1-(furan-2-yl)propyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine (PubChem CID 62632367) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is N-[1-(furan-2-yl)propyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine.

Molecular Properties

Compound NameN-[1-(furan-2-yl)propyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
PubChem CID62632367
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC NameN-[1-(furan-2-yl)propyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
SMILESCCC(NC1CCN2CCCC12)c1ccco1
InChIInChI=1S/C14H22N2O/c1-2-11(14-6-4-10-17-14)15-12-7-9-16-8-3-5-13(12)16/h4,6,10-13,15H,2-3,5,7-9H2,1H3
InChIKeyVXZODGYPEYYSBR-UHFFFAOYSA-N
XLogP2.56
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[1-(furan-2-yl)propyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine with MolForge

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Related Compounds

N-[furan-2-yl(phenyl)methyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
CID 43752370
N-[1-(4-methylphenyl)propyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
CID 43752400
N-(1-phenylbutyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
CID 43752179
N-[1-(4-bromophenyl)propyl]-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine
CID 43694264
N-heptan-4-yl-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
CID 43752336
N-[1-(furan-2-yl)propyl]-3,5-dimethylcyclohexan-1-amine
CID 64731661
N-[1-(furan-2-yl)propyl]adamantan-2-amine
CID 63443191
N-(cyclohexylmethyl)-1-(furan-2-yl)propan-1-amine
CID 62633963
N-(1-cyclopropylethyl)-1-(furan-2-yl)propan-1-amine
CID 62632332
N-(2-cyclopentylethyl)-1-(furan-2-yl)propan-1-amine
CID 62633625
N-(1-cyclohexylethyl)-1-(furan-2-yl)propan-1-amine
CID 62631853
1-(furan-2-yl)-N-[(1R)-1-(furan-2-yl)ethyl]propan-1-amine
CID 81403040

Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-yl)propyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine?
The IUPAC name of N-[1-(furan-2-yl)propyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine (CID 62632367) is N-[1-(furan-2-yl)propyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine.
What is the SMILES notation for N-[1-(furan-2-yl)propyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine?
The canonical SMILES for N-[1-(furan-2-yl)propyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine is CCC(NC1CCN2CCCC12)c1ccco1.
What is the InChIKey of N-[1-(furan-2-yl)propyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine?
The InChIKey is VXZODGYPEYYSBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-2-11(14-6-4-10-17-14)15-12-7-9-16-8-3-5-13(12)16/h4,6,10-13,15H,2-3,5,7-9H2,1H3.
What are the key properties of N-[1-(furan-2-yl)propyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine?
N-[1-(furan-2-yl)propyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine has a molecular weight of 234.34 g/mol, XLogP of 2.56, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-yl)propyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine is sourced from PubChem (CID 62632367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).