3-(2,3-dihydro-1-benzofuran-6-ylmethyl)piperidine

C14H19NO — CID 84785524

IUPAC3-(2,3-dihydro-1-benzofuran-6-ylmethyl)piperidine
SMILESc1cc2c(cc1CC1CCCNC1)OCC2
InChIInChI=1S/C14H19NO/c1-2-12(10-15-6-1)8-11-3-4-13-5-7-16-14(13)9-11/h3-4,9,12,15H,1-2,5-8,10H2
InChIKeyPUAIBRBTALRPEU-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.16
Rot. Bonds2

About 3-(2,3-dihydro-1-benzofuran-6-ylmethyl)piperidine

3-(2,3-dihydro-1-benzofuran-6-ylmethyl)piperidine (PubChem CID 84785524) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 3-(2,3-dihydro-1-benzofuran-6-ylmethyl)piperidine.

Molecular Properties

Compound Name3-(2,3-dihydro-1-benzofuran-6-ylmethyl)piperidine
PubChem CID84785524
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name3-(2,3-dihydro-1-benzofuran-6-ylmethyl)piperidine
SMILESc1cc2c(cc1CC1CCCNC1)OCC2
InChIInChI=1S/C14H19NO/c1-2-12(10-15-6-1)8-11-3-4-13-5-7-16-14(13)9-11/h3-4,9,12,15H,1-2,5-8,10H2
InChIKeyPUAIBRBTALRPEU-UHFFFAOYSA-N
XLogP2.16
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-7-(piperidin-3-ylmethyl)-2,3-dihydro-1,4-benzoxazine
CID 117368648
3-[3-(2,3-dihydro-1-benzofuran-5-yl)propyl]piperidine
CID 65446309
N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-N-methyl-1-piperidin-3-ylmethanamine
CID 106623790
N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-piperidin-3-ylethanamine
CID 115211376
2-(2,3-dihydro-1-benzofuran-6-ylmethyl)cyclopentan-1-amine
CID 82393396
3-(3,4-dihydro-1H-isochromen-6-ylmethyl)pyrrolidine
CID 84785512
6-(piperidin-3-ylmethyl)-4-propan-2-yl-2,3-dihydro-1,4-benzoxazine
CID 82340146
1-methyl-7-(piperidin-3-ylmethyl)-3,4-dihydro-2H-quinoline
CID 117363448
3-[(9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-7-yl)methyl]piperidine
CID 82245842
(3R)-3-(2,3-dihydro-1-benzofuran-6-yl)pyrrolidine
CID 96748686
3-[(3,4-dimethoxyphenyl)methyl]piperidine;hydrochloride
CID 17039525
N-(2-piperidin-3-ylethyl)-2,3-dihydro-1-benzofuran-5-amine
CID 115211290

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dihydro-1-benzofuran-6-ylmethyl)piperidine?
The IUPAC name of 3-(2,3-dihydro-1-benzofuran-6-ylmethyl)piperidine (CID 84785524) is 3-(2,3-dihydro-1-benzofuran-6-ylmethyl)piperidine.
What is the SMILES notation for 3-(2,3-dihydro-1-benzofuran-6-ylmethyl)piperidine?
The canonical SMILES for 3-(2,3-dihydro-1-benzofuran-6-ylmethyl)piperidine is c1cc2c(cc1CC1CCCNC1)OCC2.
What is the InChIKey of 3-(2,3-dihydro-1-benzofuran-6-ylmethyl)piperidine?
The InChIKey is PUAIBRBTALRPEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-2-12(10-15-6-1)8-11-3-4-13-5-7-16-14(13)9-11/h3-4,9,12,15H,1-2,5-8,10H2.
What are the key properties of 3-(2,3-dihydro-1-benzofuran-6-ylmethyl)piperidine?
3-(2,3-dihydro-1-benzofuran-6-ylmethyl)piperidine has a molecular weight of 217.31 g/mol, XLogP of 2.16, 2 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-6-ylmethyl)piperidine is sourced from PubChem (CID 84785524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).