1-(furan-2-yl)-N'-[1-(4-methoxyphenyl)ethyl]-N,N-dimethylethane-1,2-diamine

C17H24N2O2 — CID 43202375

IUPAC1-(furan-2-yl)-N'-[1-(4-methoxyphenyl)ethyl]-N,N-dimethylethane-1,2-diamine
SMILESCOc1ccc(C(C)NCC(c2ccco2)N(C)C)cc1
InChIInChI=1S/C17H24N2O2/c1-13(14-7-9-15(20-4)10-8-14)18-12-16(19(2)3)17-6-5-11-21-17/h5-11,13,16,18H,12H2,1-4H3
InChIKeyIXKAWYZJYVHAHU-UHFFFAOYSA-N
MW288.39 g/mol
LogP3.24
Rot. Bonds7

About 1-(furan-2-yl)-N'-[1-(4-methoxyphenyl)ethyl]-N,N-dimethylethane-1,2-diamine

1-(furan-2-yl)-N'-[1-(4-methoxyphenyl)ethyl]-N,N-dimethylethane-1,2-diamine (PubChem CID 43202375) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 1-(furan-2-yl)-N'-[1-(4-methoxyphenyl)ethyl]-N,N-dimethylethane-1,2-diamine.

Molecular Properties

Compound Name1-(furan-2-yl)-N'-[1-(4-methoxyphenyl)ethyl]-N,N-dimethylethane-1,2-diamine
PubChem CID43202375
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name1-(furan-2-yl)-N'-[1-(4-methoxyphenyl)ethyl]-N,N-dimethylethane-1,2-diamine
SMILESCOc1ccc(C(C)NCC(c2ccco2)N(C)C)cc1
InChIInChI=1S/C17H24N2O2/c1-13(14-7-9-15(20-4)10-8-14)18-12-16(19(2)3)17-6-5-11-21-17/h5-11,13,16,18H,12H2,1-4H3
InChIKeyIXKAWYZJYVHAHU-UHFFFAOYSA-N
XLogP3.24
TPSA37.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(furan-2-yl)-N'-[1-(3-methoxyphenyl)ethyl]-N,N-dimethylethane-1,2-diamine
CID 43202378
1-(furan-2-yl)-N'-[1-(furan-2-yl)ethyl]-N,N-dimethylethane-1,2-diamine
CID 43202373
N'-[1-(furan-2-yl)ethyl]-N,N-dimethyl-1-phenylethane-1,2-diamine
CID 43201793
(1S)-N-[1-(furan-2-yl)ethyl]-1-(4-methoxyphenyl)ethanamine
CID 81371559
N'-[1-(3-fluorophenyl)ethyl]-1-(furan-2-yl)-N,N-dimethylethane-1,2-diamine
CID 43202397
N'-[1-(3-bromophenyl)ethyl]-1-(furan-2-yl)-N,N-dimethylethane-1,2-diamine
CID 43202354
3-[4-[(1R)-1-[[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]amino]ethyl]phenyl]-1,3-oxazolidin-2-one
CID 97088424
3-cyclopropyl-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-(4-methoxyphenyl)propanamide
CID 110302123
1,3-bis[[(1S)-1-(4-methoxyphenyl)ethyl]amino]propan-2-ol
CID 71136549
N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-methylbutan-1-amine
CID 81370465
N'-[1-(2,4-dichlorophenyl)ethyl]-1-(furan-2-yl)-N,N-dimethylethane-1,2-diamine
CID 43093421
N'-[1-(2,5-difluorophenyl)ethyl]-1-(furan-2-yl)-N,N-dimethylethane-1,2-diamine
CID 43202391

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-N'-[1-(4-methoxyphenyl)ethyl]-N,N-dimethylethane-1,2-diamine?
The IUPAC name of 1-(furan-2-yl)-N'-[1-(4-methoxyphenyl)ethyl]-N,N-dimethylethane-1,2-diamine (CID 43202375) is 1-(furan-2-yl)-N'-[1-(4-methoxyphenyl)ethyl]-N,N-dimethylethane-1,2-diamine.
What is the SMILES notation for 1-(furan-2-yl)-N'-[1-(4-methoxyphenyl)ethyl]-N,N-dimethylethane-1,2-diamine?
The canonical SMILES for 1-(furan-2-yl)-N'-[1-(4-methoxyphenyl)ethyl]-N,N-dimethylethane-1,2-diamine is COc1ccc(C(C)NCC(c2ccco2)N(C)C)cc1.
What is the InChIKey of 1-(furan-2-yl)-N'-[1-(4-methoxyphenyl)ethyl]-N,N-dimethylethane-1,2-diamine?
The InChIKey is IXKAWYZJYVHAHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-13(14-7-9-15(20-4)10-8-14)18-12-16(19(2)3)17-6-5-11-21-17/h5-11,13,16,18H,12H2,1-4H3.
What are the key properties of 1-(furan-2-yl)-N'-[1-(4-methoxyphenyl)ethyl]-N,N-dimethylethane-1,2-diamine?
1-(furan-2-yl)-N'-[1-(4-methoxyphenyl)ethyl]-N,N-dimethylethane-1,2-diamine has a molecular weight of 288.39 g/mol, XLogP of 3.24, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-N'-[1-(4-methoxyphenyl)ethyl]-N,N-dimethylethane-1,2-diamine is sourced from PubChem (CID 43202375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).