3-(2,3-dihydro-1-benzofuran-7-yl)-5-methylpiperidine

C14H19NO — CID 106781652

IUPAC3-(2,3-dihydro-1-benzofuran-7-yl)-5-methylpiperidine
SMILESCC1CNCC(c2cccc3c2OCC3)C1
InChIInChI=1S/C14H19NO/c1-10-7-12(9-15-8-10)13-4-2-3-11-5-6-16-14(11)13/h2-4,10,12,15H,5-9H2,1H3
InChIKeyLCTLRTMGOBUFBI-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.33
Rot. Bonds1

About 3-(2,3-dihydro-1-benzofuran-7-yl)-5-methylpiperidine

3-(2,3-dihydro-1-benzofuran-7-yl)-5-methylpiperidine (PubChem CID 106781652) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 3-(2,3-dihydro-1-benzofuran-7-yl)-5-methylpiperidine.

Molecular Properties

Compound Name3-(2,3-dihydro-1-benzofuran-7-yl)-5-methylpiperidine
PubChem CID106781652
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name3-(2,3-dihydro-1-benzofuran-7-yl)-5-methylpiperidine
SMILESCC1CNCC(c2cccc3c2OCC3)C1
InChIInChI=1S/C14H19NO/c1-10-7-12(9-15-8-10)13-4-2-3-11-5-6-16-14(11)13/h2-4,10,12,15H,5-9H2,1H3
InChIKeyLCTLRTMGOBUFBI-UHFFFAOYSA-N
XLogP2.33
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2,3-dihydro-1-benzofuran-7-yl)pyrrolidine
CID 82602979
2-(2,3-dihydro-1-benzofuran-7-yl)-4-methylpiperidine
CID 114746819
3-(2,3-difluorophenyl)-5-methylpiperidine
CID 115502757
3-(2,3-dihydro-1-benzofuran-7-yloxy)azetidine
CID 84663192
(2R)-2-(2,3-dihydro-1-benzofuran-7-yl)azetidine
CID 130680225
7-[2-(2-methylpropyl)cyclopropyl]-2,3-dihydro-1-benzofuran
CID 177208812
3-methyl-5-[2-(trifluoromethoxy)phenyl]piperidine
CID 115375237
2,3-dihydro-1-benzofuran-7-yl-(4-methylpyrrolidin-3-yl)methanone
CID 114747881
N-[[2-(2,3-dihydro-1-benzofuran-7-yl)-4-methylcyclohexyl]methyl]cyclopropanamine
CID 114747647
3-(2,3-dihydro-1-benzofuran-7-yl)-N,2-dimethylcyclopentan-1-amine
CID 114746981
ethane;7-methyl-2,3-dihydro-1-benzofuran
CID 91503061
2-(azetidin-3-yl)-1-(2,3-dihydro-1-benzofuran-7-yl)propan-1-one
CID 114748121

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dihydro-1-benzofuran-7-yl)-5-methylpiperidine?
The IUPAC name of 3-(2,3-dihydro-1-benzofuran-7-yl)-5-methylpiperidine (CID 106781652) is 3-(2,3-dihydro-1-benzofuran-7-yl)-5-methylpiperidine.
What is the SMILES notation for 3-(2,3-dihydro-1-benzofuran-7-yl)-5-methylpiperidine?
The canonical SMILES for 3-(2,3-dihydro-1-benzofuran-7-yl)-5-methylpiperidine is CC1CNCC(c2cccc3c2OCC3)C1.
What is the InChIKey of 3-(2,3-dihydro-1-benzofuran-7-yl)-5-methylpiperidine?
The InChIKey is LCTLRTMGOBUFBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-10-7-12(9-15-8-10)13-4-2-3-11-5-6-16-14(11)13/h2-4,10,12,15H,5-9H2,1H3.
What are the key properties of 3-(2,3-dihydro-1-benzofuran-7-yl)-5-methylpiperidine?
3-(2,3-dihydro-1-benzofuran-7-yl)-5-methylpiperidine has a molecular weight of 217.31 g/mol, XLogP of 2.33, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dihydro-1-benzofuran-7-yl)-5-methylpiperidine is sourced from PubChem (CID 106781652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).