N-[[5-(2-pyrrolidin-1-ylethoxymethyl)furan-2-yl]methyl]propan-2-amine

C15H26N2O2 — CID 62459300

IUPACN-[[5-(2-pyrrolidin-1-ylethoxymethyl)furan-2-yl]methyl]propan-2-amine
SMILESCC(C)NCc1ccc(COCCN2CCCC2)o1
InChIInChI=1S/C15H26N2O2/c1-13(2)16-11-14-5-6-15(19-14)12-18-10-9-17-7-3-4-8-17/h5-6,13,16H,3-4,7-12H2,1-2H3
InChIKeyFWMNDKVTBIVUBO-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.39
Rot. Bonds8

About N-[[5-(2-pyrrolidin-1-ylethoxymethyl)furan-2-yl]methyl]propan-2-amine

N-[[5-(2-pyrrolidin-1-ylethoxymethyl)furan-2-yl]methyl]propan-2-amine (PubChem CID 62459300) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is N-[[5-(2-pyrrolidin-1-ylethoxymethyl)furan-2-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[5-(2-pyrrolidin-1-ylethoxymethyl)furan-2-yl]methyl]propan-2-amine
PubChem CID62459300
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC NameN-[[5-(2-pyrrolidin-1-ylethoxymethyl)furan-2-yl]methyl]propan-2-amine
SMILESCC(C)NCc1ccc(COCCN2CCCC2)o1
InChIInChI=1S/C15H26N2O2/c1-13(2)16-11-14-5-6-15(19-14)12-18-10-9-17-7-3-4-8-17/h5-6,13,16H,3-4,7-12H2,1-2H3
InChIKeyFWMNDKVTBIVUBO-UHFFFAOYSA-N
XLogP2.39
TPSA37.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[[5-(3-methylbutoxymethyl)furan-2-yl]methyl]propan-2-amine
CID 62444595
N-[[2-(2-pyrrolidin-1-ylethoxymethyl)furan-3-yl]methyl]propan-2-amine
CID 62458420
N-[[5-[[methyl(2-pyrrolidin-1-ylethyl)amino]methyl]furan-2-yl]methyl]propan-2-amine
CID 63210843
N-[[3-(2-pyrrolidin-1-ylethoxymethyl)phenyl]methyl]propan-2-amine
CID 62460740
N-[[5-(furan-2-ylmethoxymethyl)furan-2-yl]methyl]propan-2-amine
CID 62443693
N-[[5-(but-2-enoxymethyl)furan-2-yl]methyl]propan-2-amine
CID 76943533
N-[[5-[(3,4,5-trimethylpiperazin-1-yl)methyl]furan-2-yl]methyl]propan-2-amine
CID 114537889
N-[[5-[(4-methylazepan-1-yl)methyl]furan-2-yl]methyl]propan-2-amine
CID 63627373
N-[[5-[(3-propoxypiperidin-1-yl)methyl]furan-2-yl]methyl]propan-2-amine
CID 62411193
1-[2-[(4-propan-2-ylphenyl)methoxy]ethyl]piperidine
CID 58513850
N-methyl-1-[5-methyl-4-(2-pyrrolidin-1-ylethoxymethyl)furan-2-yl]methanamine
CID 55076653
N-methyl-1-[3-(2-pyrrolidin-1-ylethoxymethyl)-1-benzofuran-2-yl]methanamine
CID 62459476

Frequently Asked Questions

What is the IUPAC name of N-[[5-(2-pyrrolidin-1-ylethoxymethyl)furan-2-yl]methyl]propan-2-amine?
The IUPAC name of N-[[5-(2-pyrrolidin-1-ylethoxymethyl)furan-2-yl]methyl]propan-2-amine (CID 62459300) is N-[[5-(2-pyrrolidin-1-ylethoxymethyl)furan-2-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[5-(2-pyrrolidin-1-ylethoxymethyl)furan-2-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[5-(2-pyrrolidin-1-ylethoxymethyl)furan-2-yl]methyl]propan-2-amine is CC(C)NCc1ccc(COCCN2CCCC2)o1.
What is the InChIKey of N-[[5-(2-pyrrolidin-1-ylethoxymethyl)furan-2-yl]methyl]propan-2-amine?
The InChIKey is FWMNDKVTBIVUBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-13(2)16-11-14-5-6-15(19-14)12-18-10-9-17-7-3-4-8-17/h5-6,13,16H,3-4,7-12H2,1-2H3.
What are the key properties of N-[[5-(2-pyrrolidin-1-ylethoxymethyl)furan-2-yl]methyl]propan-2-amine?
N-[[5-(2-pyrrolidin-1-ylethoxymethyl)furan-2-yl]methyl]propan-2-amine has a molecular weight of 266.38 g/mol, XLogP of 2.39, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(2-pyrrolidin-1-ylethoxymethyl)furan-2-yl]methyl]propan-2-amine is sourced from PubChem (CID 62459300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).