1-[5-(phenylmethoxymethyl)furan-2-yl]propan-1-amine

C15H19NO2 — CID 132524431

IUPAC1-[5-(phenylmethoxymethyl)furan-2-yl]propan-1-amine
SMILESCCC(N)c1ccc(COCc2ccccc2)o1
InChIInChI=1S/C15H19NO2/c1-2-14(16)15-9-8-13(18-15)11-17-10-12-6-4-3-5-7-12/h3-9,14H,2,10-11,16H2,1H3
InChIKeyXWYZJJIKPIICGG-UHFFFAOYSA-N
MW245.32 g/mol
LogP3.41
Rot. Bonds6

About 1-[5-(phenylmethoxymethyl)furan-2-yl]propan-1-amine

1-[5-(phenylmethoxymethyl)furan-2-yl]propan-1-amine (PubChem CID 132524431) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is 1-[5-(phenylmethoxymethyl)furan-2-yl]propan-1-amine.

Molecular Properties

Compound Name1-[5-(phenylmethoxymethyl)furan-2-yl]propan-1-amine
PubChem CID132524431
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name1-[5-(phenylmethoxymethyl)furan-2-yl]propan-1-amine
SMILESCCC(N)c1ccc(COCc2ccccc2)o1
InChIInChI=1S/C15H19NO2/c1-2-14(16)15-9-8-13(18-15)11-17-10-12-6-4-3-5-7-12/h3-9,14H,2,10-11,16H2,1H3
InChIKeyXWYZJJIKPIICGG-UHFFFAOYSA-N
XLogP3.41
TPSA48.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(phenylmethoxymethyl)-5-[5-(phenylmethoxymethyl)furan-2-yl]furan
CID 102127806
ethane;phenylmethoxymethylbenzene
CID 90943549
5-(phenylmethoxymethyl)furan-2-carbaldehyde
CID 4739192
(R)-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-[5-(phenylmethoxymethyl)furan-2-yl]methanol
CID 15098486
CID 66734377
CID 66734377
(1R)-1-[4-(phenylmethoxymethoxy)phenyl]propan-1-amine
CID 102939494
1-ethyl-4-(phenylmethoxymethyl)benzene
CID 123410479
(213C)ethoxymethylbenzene
CID 87947851
dimethyltin;phenylmethoxymethylbenzene
CID 87392963
N-methylmethanamine;phenylmethoxymethylbenzene
CID 70181699
1-(4-phenylmethoxyphenyl)propan-1-amine
CID 16795854
1-[5-[2-(methoxymethyl)phenyl]furan-2-yl]propan-1-amine
CID 62633129

Frequently Asked Questions

What is the IUPAC name of 1-[5-(phenylmethoxymethyl)furan-2-yl]propan-1-amine?
The IUPAC name of 1-[5-(phenylmethoxymethyl)furan-2-yl]propan-1-amine (CID 132524431) is 1-[5-(phenylmethoxymethyl)furan-2-yl]propan-1-amine.
What is the SMILES notation for 1-[5-(phenylmethoxymethyl)furan-2-yl]propan-1-amine?
The canonical SMILES for 1-[5-(phenylmethoxymethyl)furan-2-yl]propan-1-amine is CCC(N)c1ccc(COCc2ccccc2)o1.
What is the InChIKey of 1-[5-(phenylmethoxymethyl)furan-2-yl]propan-1-amine?
The InChIKey is XWYZJJIKPIICGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-2-14(16)15-9-8-13(18-15)11-17-10-12-6-4-3-5-7-12/h3-9,14H,2,10-11,16H2,1H3.
What are the key properties of 1-[5-(phenylmethoxymethyl)furan-2-yl]propan-1-amine?
1-[5-(phenylmethoxymethyl)furan-2-yl]propan-1-amine has a molecular weight of 245.32 g/mol, XLogP of 3.41, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(phenylmethoxymethyl)furan-2-yl]propan-1-amine is sourced from PubChem (CID 132524431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).