4-(furan-2-yl)-N-[2-(3-methoxyphenyl)ethyl]butan-2-amine

C17H23NO2 — CID 103777711

IUPAC4-(furan-2-yl)-N-[2-(3-methoxyphenyl)ethyl]butan-2-amine
SMILESCOc1cccc(CCNC(C)CCc2ccco2)c1
InChIInChI=1S/C17H23NO2/c1-14(8-9-16-7-4-12-20-16)18-11-10-15-5-3-6-17(13-15)19-2/h3-7,12-14,18H,8-11H2,1-2H3
InChIKeyUVWZDUHTIMRGBG-UHFFFAOYSA-N
MW273.38 g/mol
LogP3.44
Rot. Bonds8

About 4-(furan-2-yl)-N-[2-(3-methoxyphenyl)ethyl]butan-2-amine

4-(furan-2-yl)-N-[2-(3-methoxyphenyl)ethyl]butan-2-amine (PubChem CID 103777711) has the molecular formula C17H23NO2 and a molecular weight of 273.38 g/mol. Its IUPAC name is 4-(furan-2-yl)-N-[2-(3-methoxyphenyl)ethyl]butan-2-amine.

Molecular Properties

Compound Name4-(furan-2-yl)-N-[2-(3-methoxyphenyl)ethyl]butan-2-amine
PubChem CID103777711
Molecular FormulaC17H23NO2
Molecular Weight273.38 g/mol
Exact Mass273.17
IUPAC Name4-(furan-2-yl)-N-[2-(3-methoxyphenyl)ethyl]butan-2-amine
SMILESCOc1cccc(CCNC(C)CCc2ccco2)c1
InChIInChI=1S/C17H23NO2/c1-14(8-9-16-7-4-12-20-16)18-11-10-15-5-3-6-17(13-15)19-2/h3-7,12-14,18H,8-11H2,1-2H3
InChIKeyUVWZDUHTIMRGBG-UHFFFAOYSA-N
XLogP3.44
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(furan-2-yl)-N-[2-(3-methoxyphenyl)ethyl]butan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(furan-2-yl)-N-[2-(3-methylphenyl)ethyl]butan-2-amine
CID 62312823
[4-(furan-2-yl)-1-(3-methoxyphenyl)butan-2-yl]hydrazine
CID 105295310
1-[2-(furan-2-yl)ethyl]-3-[2-(3-methoxyphenyl)ethyl]-2-methylguanidine
CID 111355726
N'-tert-butyl-N-[4-(furan-2-yl)butan-2-yl]ethane-1,2-diamine
CID 107444697
methyl 3-[4-(furan-2-yl)butan-2-ylamino]propanoate
CID 43478962
N-butyl-4-(furan-2-yl)butan-2-amine
CID 43182419
N-[4-(furan-2-yl)butan-2-yl]-2,5-dimethoxyaniline
CID 43478801
N-[2-(3-methoxyphenyl)ethyl]-1-(5-methylfuran-2-yl)ethanamine
CID 103777751
N-[2-(3-methoxyphenyl)ethyl]-3,3-dimethylbutan-2-amine
CID 126843908
N-[2-(3-methoxyphenyl)ethyl]heptan-4-amine
CID 103729443
1,1-dimethoxy-N-[2-(3-methoxyphenyl)ethyl]propan-2-amine
CID 107850250
4-(furan-2-yl)-N-[2-(1-methylpyrazol-4-yl)ethyl]butan-2-amine
CID 80682006

Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-yl)-N-[2-(3-methoxyphenyl)ethyl]butan-2-amine?
The IUPAC name of 4-(furan-2-yl)-N-[2-(3-methoxyphenyl)ethyl]butan-2-amine (CID 103777711) is 4-(furan-2-yl)-N-[2-(3-methoxyphenyl)ethyl]butan-2-amine.
What is the SMILES notation for 4-(furan-2-yl)-N-[2-(3-methoxyphenyl)ethyl]butan-2-amine?
The canonical SMILES for 4-(furan-2-yl)-N-[2-(3-methoxyphenyl)ethyl]butan-2-amine is COc1cccc(CCNC(C)CCc2ccco2)c1.
What is the InChIKey of 4-(furan-2-yl)-N-[2-(3-methoxyphenyl)ethyl]butan-2-amine?
The InChIKey is UVWZDUHTIMRGBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO2/c1-14(8-9-16-7-4-12-20-16)18-11-10-15-5-3-6-17(13-15)19-2/h3-7,12-14,18H,8-11H2,1-2H3.
What are the key properties of 4-(furan-2-yl)-N-[2-(3-methoxyphenyl)ethyl]butan-2-amine?
4-(furan-2-yl)-N-[2-(3-methoxyphenyl)ethyl]butan-2-amine has a molecular weight of 273.38 g/mol, XLogP of 3.44, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-yl)-N-[2-(3-methoxyphenyl)ethyl]butan-2-amine is sourced from PubChem (CID 103777711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).