N-[[2-[(4-fluorophenoxy)methyl]furan-3-yl]methyl]cyclopropanamine

C15H16FNO2 — CID 62453268

IUPACN-[[2-[(4-fluorophenoxy)methyl]furan-3-yl]methyl]cyclopropanamine
SMILESFc1ccc(OCc2occc2CNC2CC2)cc1
InChIInChI=1S/C15H16FNO2/c16-12-1-5-14(6-2-12)19-10-15-11(7-8-18-15)9-17-13-3-4-13/h1-2,5-8,13,17H,3-4,9-10H2
InChIKeyRPKMXPHYIMUGRK-UHFFFAOYSA-N
MW261.30 g/mol
LogP3.25
Rot. Bonds6

About N-[[2-[(4-fluorophenoxy)methyl]furan-3-yl]methyl]cyclopropanamine

N-[[2-[(4-fluorophenoxy)methyl]furan-3-yl]methyl]cyclopropanamine (PubChem CID 62453268) has the molecular formula C15H16FNO2 and a molecular weight of 261.30 g/mol. Its IUPAC name is N-[[2-[(4-fluorophenoxy)methyl]furan-3-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[2-[(4-fluorophenoxy)methyl]furan-3-yl]methyl]cyclopropanamine
PubChem CID62453268
Molecular FormulaC15H16FNO2
Molecular Weight261.30 g/mol
Exact Mass261.12
IUPAC NameN-[[2-[(4-fluorophenoxy)methyl]furan-3-yl]methyl]cyclopropanamine
SMILESFc1ccc(OCc2occc2CNC2CC2)cc1
InChIInChI=1S/C15H16FNO2/c16-12-1-5-14(6-2-12)19-10-15-11(7-8-18-15)9-17-13-3-4-13/h1-2,5-8,13,17H,3-4,9-10H2
InChIKeyRPKMXPHYIMUGRK-UHFFFAOYSA-N
XLogP3.25
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.30
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-3-yl]methyl]cyclopropanamine
CID 62459443
N-[[2-(methoxymethyl)furan-3-yl]methyl]cyclopropanamine
CID 62444084
N-[[2-[(5-chloro-3-pyridinyl)oxymethyl]furan-3-yl]methyl]cyclopropanamine
CID 64602366
N-[[2-[(2,3-dichlorophenoxy)methyl]furan-3-yl]methyl]cyclopropanamine
CID 62449785
N-[[4-[(4-fluorophenoxy)methyl]phenyl]methyl]cyclopropanamine
CID 62454139
N-[[2-(butan-2-yloxymethyl)furan-3-yl]methyl]cyclopropanamine
CID 62454822
N-[[3-[(2-chloro-4-fluorophenoxy)methyl]furan-2-yl]methyl]cyclopropanamine
CID 62452095
N-[[2-[(2-prop-2-enylphenoxy)methyl]furan-3-yl]methyl]cyclopropanamine
CID 62523408
N-[[2-(oxan-4-ylmethoxymethyl)furan-3-yl]methyl]cyclopropanamine
CID 62484757
N-[[3-[(3-chlorophenoxy)methyl]furan-2-yl]methyl]cyclopropanamine
CID 62459727
N-[[3-[(2-fluoro-3-methylphenoxy)methyl]furan-2-yl]methyl]cyclopropanamine
CID 107661302
N-[[4-[(4-fluorophenoxy)methyl]-1,3-thiazol-2-yl]methyl]cyclopropanamine
CID 55076744

Frequently Asked Questions

What is the IUPAC name of N-[[2-[(4-fluorophenoxy)methyl]furan-3-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[2-[(4-fluorophenoxy)methyl]furan-3-yl]methyl]cyclopropanamine (CID 62453268) is N-[[2-[(4-fluorophenoxy)methyl]furan-3-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[2-[(4-fluorophenoxy)methyl]furan-3-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[2-[(4-fluorophenoxy)methyl]furan-3-yl]methyl]cyclopropanamine is Fc1ccc(OCc2occc2CNC2CC2)cc1.
What is the InChIKey of N-[[2-[(4-fluorophenoxy)methyl]furan-3-yl]methyl]cyclopropanamine?
The InChIKey is RPKMXPHYIMUGRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO2/c16-12-1-5-14(6-2-12)19-10-15-11(7-8-18-15)9-17-13-3-4-13/h1-2,5-8,13,17H,3-4,9-10H2.
What are the key properties of N-[[2-[(4-fluorophenoxy)methyl]furan-3-yl]methyl]cyclopropanamine?
N-[[2-[(4-fluorophenoxy)methyl]furan-3-yl]methyl]cyclopropanamine has a molecular weight of 261.30 g/mol, XLogP of 3.25, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-[(4-fluorophenoxy)methyl]furan-3-yl]methyl]cyclopropanamine is sourced from PubChem (CID 62453268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).