3-(furan-3-yl)-1-phenylpropan-1-amine

C13H15NO — CID 64505845

IUPAC3-(furan-3-yl)-1-phenylpropan-1-amine
SMILESNC(CCc1ccoc1)c1ccccc1
InChIInChI=1S/C13H15NO/c14-13(12-4-2-1-3-5-12)7-6-11-8-9-15-10-11/h1-5,8-10,13H,6-7,14H2
InChIKeyBEWROPKBQRKWRR-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.91
Rot. Bonds4

About 3-(furan-3-yl)-1-phenylpropan-1-amine

3-(furan-3-yl)-1-phenylpropan-1-amine (PubChem CID 64505845) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is 3-(furan-3-yl)-1-phenylpropan-1-amine.

Molecular Properties

Compound Name3-(furan-3-yl)-1-phenylpropan-1-amine
PubChem CID64505845
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC Name3-(furan-3-yl)-1-phenylpropan-1-amine
SMILESNC(CCc1ccoc1)c1ccccc1
InChIInChI=1S/C13H15NO/c14-13(12-4-2-1-3-5-12)7-6-11-8-9-15-10-11/h1-5,8-10,13H,6-7,14H2
InChIKeyBEWROPKBQRKWRR-UHFFFAOYSA-N
XLogP2.91
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopropyl-3-(furan-3-yl)propan-1-amine
CID 64506064
1-amino-3-(furan-3-yl)-1-phenylpropan-2-one
CID 116551301
(1R)-1,4-diphenylbutan-1-amine
CID 7131342
3-(3-chlorobutyl)furan
CID 64514685
3-(3-bromofuran-2-yl)-1-phenylpropan-1-amine
CID 64502548
3-naphthalen-1-yl-1-phenylpropan-1-amine
CID 43370421
[1-(furan-3-yl)-3-phenylpropyl]hydrazine
CID 105205786
3-(3-bromo-4-fluorophenyl)-1-phenylpropan-1-amine
CID 43175857
N-(furan-3-ylmethyl)-1-phenylethanamine
CID 42773967
1-phenyl-3-(2,3,4-trifluorophenyl)propan-1-amine
CID 64505128
1-benzhydryl-3-[2-(furan-3-yl)ethyl]urea
CID 71798567
3-(2-ethylpyrazol-3-yl)-1-phenylpropan-1-amine
CID 64503724

Frequently Asked Questions

What is the IUPAC name of 3-(furan-3-yl)-1-phenylpropan-1-amine?
The IUPAC name of 3-(furan-3-yl)-1-phenylpropan-1-amine (CID 64505845) is 3-(furan-3-yl)-1-phenylpropan-1-amine.
What is the SMILES notation for 3-(furan-3-yl)-1-phenylpropan-1-amine?
The canonical SMILES for 3-(furan-3-yl)-1-phenylpropan-1-amine is NC(CCc1ccoc1)c1ccccc1.
What is the InChIKey of 3-(furan-3-yl)-1-phenylpropan-1-amine?
The InChIKey is BEWROPKBQRKWRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO/c14-13(12-4-2-1-3-5-12)7-6-11-8-9-15-10-11/h1-5,8-10,13H,6-7,14H2.
What are the key properties of 3-(furan-3-yl)-1-phenylpropan-1-amine?
3-(furan-3-yl)-1-phenylpropan-1-amine has a molecular weight of 201.27 g/mol, XLogP of 2.91, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-3-yl)-1-phenylpropan-1-amine is sourced from PubChem (CID 64505845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).