1-methyl-6-(2-methyl-1-benzofuran-3-yl)piperidin-3-amine

C15H20N2O — CID 82385540

IUPAC1-methyl-6-(2-methyl-1-benzofuran-3-yl)piperidin-3-amine
SMILESCc1oc2ccccc2c1C1CCC(N)CN1C
InChIInChI=1S/C15H20N2O/c1-10-15(12-5-3-4-6-14(12)18-10)13-8-7-11(16)9-17(13)2/h3-6,11,13H,7-9,16H2,1-2H3
InChIKeyMRAIHJOFKNRFKP-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.84
Rot. Bonds1

About 1-methyl-6-(2-methyl-1-benzofuran-3-yl)piperidin-3-amine

1-methyl-6-(2-methyl-1-benzofuran-3-yl)piperidin-3-amine (PubChem CID 82385540) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 1-methyl-6-(2-methyl-1-benzofuran-3-yl)piperidin-3-amine.

Molecular Properties

Compound Name1-methyl-6-(2-methyl-1-benzofuran-3-yl)piperidin-3-amine
PubChem CID82385540
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name1-methyl-6-(2-methyl-1-benzofuran-3-yl)piperidin-3-amine
SMILESCc1oc2ccccc2c1C1CCC(N)CN1C
InChIInChI=1S/C15H20N2O/c1-10-15(12-5-3-4-6-14(12)18-10)13-8-7-11(16)9-17(13)2/h3-6,11,13H,7-9,16H2,1-2H3
InChIKeyMRAIHJOFKNRFKP-UHFFFAOYSA-N
XLogP2.84
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-6-(2-methyl-1-benzofuran-3-yl)piperidin-3-amine?
The IUPAC name of 1-methyl-6-(2-methyl-1-benzofuran-3-yl)piperidin-3-amine (CID 82385540) is 1-methyl-6-(2-methyl-1-benzofuran-3-yl)piperidin-3-amine.
What is the SMILES notation for 1-methyl-6-(2-methyl-1-benzofuran-3-yl)piperidin-3-amine?
The canonical SMILES for 1-methyl-6-(2-methyl-1-benzofuran-3-yl)piperidin-3-amine is Cc1oc2ccccc2c1C1CCC(N)CN1C.
What is the InChIKey of 1-methyl-6-(2-methyl-1-benzofuran-3-yl)piperidin-3-amine?
The InChIKey is MRAIHJOFKNRFKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-10-15(12-5-3-4-6-14(12)18-10)13-8-7-11(16)9-17(13)2/h3-6,11,13H,7-9,16H2,1-2H3.
What are the key properties of 1-methyl-6-(2-methyl-1-benzofuran-3-yl)piperidin-3-amine?
1-methyl-6-(2-methyl-1-benzofuran-3-yl)piperidin-3-amine has a molecular weight of 244.34 g/mol, XLogP of 2.84, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-6-(2-methyl-1-benzofuran-3-yl)piperidin-3-amine is sourced from PubChem (CID 82385540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).