1-[(5-methylfuran-2-yl)methyl]-N-propylpiperidin-4-amine

C14H24N2O — CID 62524387

IUPAC1-[(5-methylfuran-2-yl)methyl]-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(Cc2ccc(C)o2)CC1
InChIInChI=1S/C14H24N2O/c1-3-8-15-13-6-9-16(10-7-13)11-14-5-4-12(2)17-14/h4-5,13,15H,3,6-11H2,1-2H3
InChIKeyMAQOOSWPFOBAPB-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.55
Rot. Bonds5

About 1-[(5-methylfuran-2-yl)methyl]-N-propylpiperidin-4-amine

1-[(5-methylfuran-2-yl)methyl]-N-propylpiperidin-4-amine (PubChem CID 62524387) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 1-[(5-methylfuran-2-yl)methyl]-N-propylpiperidin-4-amine.

Molecular Properties

Compound Name1-[(5-methylfuran-2-yl)methyl]-N-propylpiperidin-4-amine
PubChem CID62524387
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name1-[(5-methylfuran-2-yl)methyl]-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(Cc2ccc(C)o2)CC1
InChIInChI=1S/C14H24N2O/c1-3-8-15-13-6-9-16(10-7-13)11-14-5-4-12(2)17-14/h4-5,13,15H,3,6-11H2,1-2H3
InChIKeyMAQOOSWPFOBAPB-UHFFFAOYSA-N
XLogP2.55
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 ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[(5-methylfuran-2-yl)methyl]-N-propylpiperidin-4-amine?
The IUPAC name of 1-[(5-methylfuran-2-yl)methyl]-N-propylpiperidin-4-amine (CID 62524387) is 1-[(5-methylfuran-2-yl)methyl]-N-propylpiperidin-4-amine.
What is the SMILES notation for 1-[(5-methylfuran-2-yl)methyl]-N-propylpiperidin-4-amine?
The canonical SMILES for 1-[(5-methylfuran-2-yl)methyl]-N-propylpiperidin-4-amine is CCCNC1CCN(Cc2ccc(C)o2)CC1.
What is the InChIKey of 1-[(5-methylfuran-2-yl)methyl]-N-propylpiperidin-4-amine?
The InChIKey is MAQOOSWPFOBAPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-3-8-15-13-6-9-16(10-7-13)11-14-5-4-12(2)17-14/h4-5,13,15H,3,6-11H2,1-2H3.
What are the key properties of 1-[(5-methylfuran-2-yl)methyl]-N-propylpiperidin-4-amine?
1-[(5-methylfuran-2-yl)methyl]-N-propylpiperidin-4-amine has a molecular weight of 236.36 g/mol, XLogP of 2.55, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-methylfuran-2-yl)methyl]-N-propylpiperidin-4-amine is sourced from PubChem (CID 62524387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).