1-[2-[1-(furan-2-yl)ethylamino]ethyl]-N,N-dimethylpiperidin-4-amine

C15H27N3O — CID 62561360

IUPAC1-[2-[1-(furan-2-yl)ethylamino]ethyl]-N,N-dimethylpiperidin-4-amine
SMILESCC(NCCN1CCC(N(C)C)CC1)c1ccco1
InChIInChI=1S/C15H27N3O/c1-13(15-5-4-12-19-15)16-8-11-18-9-6-14(7-10-18)17(2)3/h4-5,12-14,16H,6-11H2,1-3H3
InChIKeyQJDZVYFBOKFDKH-UHFFFAOYSA-N
MW265.40 g/mol
LogP1.96
Rot. Bonds6

About 1-[2-[1-(furan-2-yl)ethylamino]ethyl]-N,N-dimethylpiperidin-4-amine

1-[2-[1-(furan-2-yl)ethylamino]ethyl]-N,N-dimethylpiperidin-4-amine (PubChem CID 62561360) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is 1-[2-[1-(furan-2-yl)ethylamino]ethyl]-N,N-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name1-[2-[1-(furan-2-yl)ethylamino]ethyl]-N,N-dimethylpiperidin-4-amine
PubChem CID62561360
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC Name1-[2-[1-(furan-2-yl)ethylamino]ethyl]-N,N-dimethylpiperidin-4-amine
SMILESCC(NCCN1CCC(N(C)C)CC1)c1ccco1
InChIInChI=1S/C15H27N3O/c1-13(15-5-4-12-19-15)16-8-11-18-9-6-14(7-10-18)17(2)3/h4-5,12-14,16H,6-11H2,1-3H3
InChIKeyQJDZVYFBOKFDKH-UHFFFAOYSA-N
XLogP1.96
TPSA31.65 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-1-(furan-2-yl)ethanamine
CID 62557602
N'-(1-ethylpiperidin-4-yl)-N-[1-(furan-2-yl)ethyl]-N'-methylethane-1,2-diamine
CID 62554630
1-(furan-2-yl)-N-[2-(2-methylmorpholin-4-yl)ethyl]ethanamine
CID 62573349
N'-cyclopentyl-N-[1-(furan-2-yl)ethyl]-N'-methylethane-1,2-diamine
CID 55138698
N-[1-(furan-2-yl)ethyl]-N'-methyl-N'-(oxan-4-yl)ethane-1,2-diamine
CID 62560272
N,N-dimethyl-1-[2-[[(1R)-1-[3-(trifluoromethyl)phenyl]ethyl]amino]ethyl]piperidin-4-amine
CID 97323333
(1R)-1-(furan-2-yl)-N-[(1-methylpiperidin-4-yl)methyl]ethanamine
CID 81403301
N-[(1R)-1-(furan-2-yl)ethyl]-1-(1-propylpiperidin-4-yl)ethanamine
CID 81403845
N-(2-cyclopentylethyl)-1-(furan-2-yl)ethanamine
CID 60919683
1-(furan-2-ylmethyl)-N,N-dimethylpiperidin-4-amine
CID 91664788
N-(2-cyclohexylethyl)-1-(furan-2-yl)ethanamine
CID 60919809
(1S)-1-(furan-2-yl)-N-[(1-methylpiperidin-2-yl)methyl]ethanamine
CID 81403117

Frequently Asked Questions

What is the IUPAC name of 1-[2-[1-(furan-2-yl)ethylamino]ethyl]-N,N-dimethylpiperidin-4-amine?
The IUPAC name of 1-[2-[1-(furan-2-yl)ethylamino]ethyl]-N,N-dimethylpiperidin-4-amine (CID 62561360) is 1-[2-[1-(furan-2-yl)ethylamino]ethyl]-N,N-dimethylpiperidin-4-amine.
What is the SMILES notation for 1-[2-[1-(furan-2-yl)ethylamino]ethyl]-N,N-dimethylpiperidin-4-amine?
The canonical SMILES for 1-[2-[1-(furan-2-yl)ethylamino]ethyl]-N,N-dimethylpiperidin-4-amine is CC(NCCN1CCC(N(C)C)CC1)c1ccco1.
What is the InChIKey of 1-[2-[1-(furan-2-yl)ethylamino]ethyl]-N,N-dimethylpiperidin-4-amine?
The InChIKey is QJDZVYFBOKFDKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-13(15-5-4-12-19-15)16-8-11-18-9-6-14(7-10-18)17(2)3/h4-5,12-14,16H,6-11H2,1-3H3.
What are the key properties of 1-[2-[1-(furan-2-yl)ethylamino]ethyl]-N,N-dimethylpiperidin-4-amine?
1-[2-[1-(furan-2-yl)ethylamino]ethyl]-N,N-dimethylpiperidin-4-amine has a molecular weight of 265.40 g/mol, XLogP of 1.96, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[1-(furan-2-yl)ethylamino]ethyl]-N,N-dimethylpiperidin-4-amine is sourced from PubChem (CID 62561360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).