(2R)-2-(1-benzofuran-2-ylmethyl)piperidine

C14H17NO — CID 94859293

IUPAC(2R)-2-(1-benzofuran-2-ylmethyl)piperidine
SMILESc1ccc2oc(C[C@H]3CCCCN3)cc2c1
InChIInChI=1S/C14H17NO/c1-2-7-14-11(5-1)9-13(16-14)10-12-6-3-4-8-15-12/h1-2,5,7,9,12,15H,3-4,6,8,10H2/t12-/m1/s1
InChIKeyBACKVISBRLZYOX-GFCCVEGCSA-N
MW215.30 g/mol
LogP3.12
Rot. Bonds2

About (2R)-2-(1-benzofuran-2-ylmethyl)piperidine

(2R)-2-(1-benzofuran-2-ylmethyl)piperidine (PubChem CID 94859293) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is (2R)-2-(1-benzofuran-2-ylmethyl)piperidine.

Molecular Properties

Compound Name(2R)-2-(1-benzofuran-2-ylmethyl)piperidine
PubChem CID94859293
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC Name(2R)-2-(1-benzofuran-2-ylmethyl)piperidine
SMILESc1ccc2oc(C[C@H]3CCCCN3)cc2c1
InChIInChI=1S/C14H17NO/c1-2-7-14-11(5-1)9-13(16-14)10-12-6-3-4-8-15-12/h1-2,5,7,9,12,15H,3-4,6,8,10H2/t12-/m1/s1
InChIKeyBACKVISBRLZYOX-GFCCVEGCSA-N
XLogP3.12
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(4-bromo-1-benzofuran-2-yl)methyl]piperidine
CID 23146342
1-(1-benzofuran-2-yl)-2-[(2S)-piperidin-2-yl]ethanone
CID 129368395
(2S)-2-(naphthalen-2-ylmethyl)piperidine
CID 94603397
N-(1-benzofuran-2-ylmethyl)-N-methyl-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119807305
1-(1-benzofuran-2-yl)-2-pyrrolidin-2-ylethanol
CID 79559824
2-(piperidin-2-ylmethyl)aniline
CID 84662844
N-[2-(1-benzofuran-2-yl)ethyl]piperidine-2-carboxamide
CID 119332486
N-(1-benzofuran-2-ylmethyl)cyclopentanamine
CID 28610923
2-(pyrrolidin-2-ylmethyl)-1,3-benzoxazole
CID 61372127
2-[(2-methyl-1-benzofuran-5-yl)methyl]piperidine
CID 117331068
2-[1-benzofuran-2-yl(fluoro)methyl]piperidine
CID 106635014
(4aS,7aS)-6-(1-benzofuran-2-ylmethyl)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridine
CID 103887013

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(1-benzofuran-2-ylmethyl)piperidine?
The IUPAC name of (2R)-2-(1-benzofuran-2-ylmethyl)piperidine (CID 94859293) is (2R)-2-(1-benzofuran-2-ylmethyl)piperidine.
What is the SMILES notation for (2R)-2-(1-benzofuran-2-ylmethyl)piperidine?
The canonical SMILES for (2R)-2-(1-benzofuran-2-ylmethyl)piperidine is c1ccc2oc(C[C@H]3CCCCN3)cc2c1.
What is the InChIKey of (2R)-2-(1-benzofuran-2-ylmethyl)piperidine?
The InChIKey is BACKVISBRLZYOX-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H17NO/c1-2-7-14-11(5-1)9-13(16-14)10-12-6-3-4-8-15-12/h1-2,5,7,9,12,15H,3-4,6,8,10H2/t12-/m1/s1.
What are the key properties of (2R)-2-(1-benzofuran-2-ylmethyl)piperidine?
(2R)-2-(1-benzofuran-2-ylmethyl)piperidine has a molecular weight of 215.30 g/mol, XLogP of 3.12, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(1-benzofuran-2-ylmethyl)piperidine is sourced from PubChem (CID 94859293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).