1-[5-(2,3-difluorophenyl)furan-2-yl]-N-ethylpropan-1-amine

C15H17F2NO — CID 62633461

IUPAC1-[5-(2,3-difluorophenyl)furan-2-yl]-N-ethylpropan-1-amine
SMILESCCNC(CC)c1ccc(-c2cccc(F)c2F)o1
InChIInChI=1S/C15H17F2NO/c1-3-12(18-4-2)14-9-8-13(19-14)10-6-5-7-11(16)15(10)17/h5-9,12,18H,3-4H2,1-2H3
InChIKeyYCVTWNIYNIUAKL-UHFFFAOYSA-N
MW265.30 g/mol
LogP4.29
Rot. Bonds5

About 1-[5-(2,3-difluorophenyl)furan-2-yl]-N-ethylpropan-1-amine

1-[5-(2,3-difluorophenyl)furan-2-yl]-N-ethylpropan-1-amine (PubChem CID 62633461) has the molecular formula C15H17F2NO and a molecular weight of 265.30 g/mol. Its IUPAC name is 1-[5-(2,3-difluorophenyl)furan-2-yl]-N-ethylpropan-1-amine.

Molecular Properties

Compound Name1-[5-(2,3-difluorophenyl)furan-2-yl]-N-ethylpropan-1-amine
PubChem CID62633461
Molecular FormulaC15H17F2NO
Molecular Weight265.30 g/mol
Exact Mass265.13
IUPAC Name1-[5-(2,3-difluorophenyl)furan-2-yl]-N-ethylpropan-1-amine
SMILESCCNC(CC)c1ccc(-c2cccc(F)c2F)o1
InChIInChI=1S/C15H17F2NO/c1-3-12(18-4-2)14-9-8-13(19-14)10-6-5-7-11(16)15(10)17/h5-9,12,18H,3-4H2,1-2H3
InChIKeyYCVTWNIYNIUAKL-UHFFFAOYSA-N
XLogP4.29
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.30
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[5-(2,3-difluorophenyl)furan-2-yl]propan-1-amine
CID 55097732
1-[5-(2-fluorophenyl)furan-2-yl]-N-propylpropan-1-amine
CID 62633103
N-ethyl-1-[5-(2-propylphenyl)furan-2-yl]propan-1-amine
CID 63398978
1-[5-(2-bromo-5-fluorophenyl)furan-2-yl]-N-ethylpropan-1-amine
CID 107626833
1-[5-(2,5-dichlorophenyl)furan-2-yl]-N-ethylpropan-1-amine
CID 63398591
N-ethyl-1-[5-(2,3,4-trifluorophenyl)furan-2-yl]ethanamine
CID 62499724
N-ethyl-1-[5-(3-iodophenyl)furan-2-yl]propan-1-amine
CID 55185572
2-(2,3-difluorophenyl)-5-methylfuran
CID 123606724
1-[5-(5-bromo-2-methylphenyl)furan-2-yl]-N-ethylpropan-1-amine
CID 63398851
1-[5-(2-chloro-4-iodophenyl)furan-2-yl]-N-ethylpropan-1-amine
CID 107607500
1-[5-(2,3-difluorophenyl)furan-2-yl]-N-methylpropan-2-amine
CID 55181893
1-[5-(2-bromo-3-chlorophenyl)furan-2-yl]-N-propylpropan-1-amine
CID 103481081

Frequently Asked Questions

What is the IUPAC name of 1-[5-(2,3-difluorophenyl)furan-2-yl]-N-ethylpropan-1-amine?
The IUPAC name of 1-[5-(2,3-difluorophenyl)furan-2-yl]-N-ethylpropan-1-amine (CID 62633461) is 1-[5-(2,3-difluorophenyl)furan-2-yl]-N-ethylpropan-1-amine.
What is the SMILES notation for 1-[5-(2,3-difluorophenyl)furan-2-yl]-N-ethylpropan-1-amine?
The canonical SMILES for 1-[5-(2,3-difluorophenyl)furan-2-yl]-N-ethylpropan-1-amine is CCNC(CC)c1ccc(-c2cccc(F)c2F)o1.
What is the InChIKey of 1-[5-(2,3-difluorophenyl)furan-2-yl]-N-ethylpropan-1-amine?
The InChIKey is YCVTWNIYNIUAKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17F2NO/c1-3-12(18-4-2)14-9-8-13(19-14)10-6-5-7-11(16)15(10)17/h5-9,12,18H,3-4H2,1-2H3.
What are the key properties of 1-[5-(2,3-difluorophenyl)furan-2-yl]-N-ethylpropan-1-amine?
1-[5-(2,3-difluorophenyl)furan-2-yl]-N-ethylpropan-1-amine has a molecular weight of 265.30 g/mol, XLogP of 4.29, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(2,3-difluorophenyl)furan-2-yl]-N-ethylpropan-1-amine is sourced from PubChem (CID 62633461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).