1-[5-[(3-ethylpiperidin-1-yl)methyl]furan-3-yl]-N-methylmethanamine

C14H24N2O — CID 62432874

IUPAC1-[5-[(3-ethylpiperidin-1-yl)methyl]furan-3-yl]-N-methylmethanamine
SMILESCCC1CCCN(Cc2cc(CNC)co2)C1
InChIInChI=1S/C14H24N2O/c1-3-12-5-4-6-16(9-12)10-14-7-13(8-15-2)11-17-14/h7,11-12,15H,3-6,8-10H2,1-2H3
InChIKeyYYIVZGCSAIVFRT-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.62
Rot. Bonds5

About 1-[5-[(3-ethylpiperidin-1-yl)methyl]furan-3-yl]-N-methylmethanamine

1-[5-[(3-ethylpiperidin-1-yl)methyl]furan-3-yl]-N-methylmethanamine (PubChem CID 62432874) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 1-[5-[(3-ethylpiperidin-1-yl)methyl]furan-3-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[5-[(3-ethylpiperidin-1-yl)methyl]furan-3-yl]-N-methylmethanamine
PubChem CID62432874
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name1-[5-[(3-ethylpiperidin-1-yl)methyl]furan-3-yl]-N-methylmethanamine
SMILESCCC1CCCN(Cc2cc(CNC)co2)C1
InChIInChI=1S/C14H24N2O/c1-3-12-5-4-6-16(9-12)10-14-7-13(8-15-2)11-17-14/h7,11-12,15H,3-6,8-10H2,1-2H3
InChIKeyYYIVZGCSAIVFRT-UHFFFAOYSA-N
XLogP2.62
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[5-[(3-ethylpiperidin-1-yl)methyl]furan-3-yl]methyl]propan-2-amine
CID 62433044
1-[5-[(4-ethylpiperidin-1-yl)methyl]furan-3-yl]-N-methylmethanamine
CID 62412564
1-[(5-bromofuran-3-yl)methyl]-3-ethylpiperidine
CID 130679519
1-[5-[(4,4-dimethylpiperidin-1-yl)methyl]furan-3-yl]-N-methylmethanamine
CID 62932027
N-[[5-[(3-propoxypiperidin-1-yl)methyl]furan-3-yl]methyl]propan-2-amine
CID 62412948
N-[[5-[(3-methoxypiperidin-1-yl)methyl]furan-3-yl]methyl]-2-methylpropan-2-amine
CID 102968121
N-[[5-[(3-ethylpiperidin-1-yl)methyl]-2-methylfuran-3-yl]methyl]propan-2-amine
CID 62432690
4-[(3-ethylpiperidin-1-yl)methyl]-2-methylaniline
CID 43584622
N-[[5-[(2-methyl-1,4-oxazepan-4-yl)methyl]furan-3-yl]methyl]cyclopropanamine
CID 62974113
2-[2-[(3-ethylpiperidin-1-yl)methyl]phenyl]-N-methylethanamine
CID 115463747
1-[5-[(5-ethyl-2-methylmorpholin-4-yl)methyl]furan-3-yl]-N-methylmethanamine
CID 62461076
1-[4-[2-(3-ethylpiperidin-1-yl)ethoxy]phenyl]-N-methylmethanamine
CID 62431792

Frequently Asked Questions

What is the IUPAC name of 1-[5-[(3-ethylpiperidin-1-yl)methyl]furan-3-yl]-N-methylmethanamine?
The IUPAC name of 1-[5-[(3-ethylpiperidin-1-yl)methyl]furan-3-yl]-N-methylmethanamine (CID 62432874) is 1-[5-[(3-ethylpiperidin-1-yl)methyl]furan-3-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[5-[(3-ethylpiperidin-1-yl)methyl]furan-3-yl]-N-methylmethanamine?
The canonical SMILES for 1-[5-[(3-ethylpiperidin-1-yl)methyl]furan-3-yl]-N-methylmethanamine is CCC1CCCN(Cc2cc(CNC)co2)C1.
What is the InChIKey of 1-[5-[(3-ethylpiperidin-1-yl)methyl]furan-3-yl]-N-methylmethanamine?
The InChIKey is YYIVZGCSAIVFRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-3-12-5-4-6-16(9-12)10-14-7-13(8-15-2)11-17-14/h7,11-12,15H,3-6,8-10H2,1-2H3.
What are the key properties of 1-[5-[(3-ethylpiperidin-1-yl)methyl]furan-3-yl]-N-methylmethanamine?
1-[5-[(3-ethylpiperidin-1-yl)methyl]furan-3-yl]-N-methylmethanamine has a molecular weight of 236.36 g/mol, XLogP of 2.62, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-[(3-ethylpiperidin-1-yl)methyl]furan-3-yl]-N-methylmethanamine is sourced from PubChem (CID 62432874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).