4-benzyl-N-[[(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl]piperidine-1-carboxamide

C22H26N2O2 — CID 35673121

IUPAC4-benzyl-N-[[(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl]piperidine-1-carboxamide
SMILESO=C(NC[C@H]1Cc2ccccc2O1)N1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C22H26N2O2/c25-22(23-16-20-15-19-8-4-5-9-21(19)26-20)24-12-10-18(11-13-24)14-17-6-2-1-3-7-17/h1-9,18,20H,10-16H2,(H,23,25)/t20-/m1/s1
InChIKeyPUXYBUKSJWJJPD-HXUWFJFHSA-N
MW350.46 g/mol
LogP3.65
Rot. Bonds4

About 4-benzyl-N-[[(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl]piperidine-1-carboxamide

4-benzyl-N-[[(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl]piperidine-1-carboxamide (PubChem CID 35673121) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is 4-benzyl-N-[[(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name4-benzyl-N-[[(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl]piperidine-1-carboxamide
PubChem CID35673121
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC Name4-benzyl-N-[[(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl]piperidine-1-carboxamide
SMILESO=C(NC[C@H]1Cc2ccccc2O1)N1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C22H26N2O2/c25-22(23-16-20-15-19-8-4-5-9-21(19)26-20)24-12-10-18(11-13-24)14-17-6-2-1-3-7-17/h1-9,18,20H,10-16H2,(H,23,25)/t20-/m1/s1
InChIKeyPUXYBUKSJWJJPD-HXUWFJFHSA-N
XLogP3.65
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-benzyl-N-[[(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl]piperidine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[(2S)-2,3-dihydro-1-benzofuran-2-yl]methyl]thiomorpholine-4-carboxamide
CID 94115982
(3R)-3-[(carbamoylamino)methyl]-N-[[(2S)-2,3-dihydro-1-benzofuran-2-yl]methyl]piperidine-1-carboxamide
CID 99813027
N-[[(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl]-4-[2-(ethylamino)-2-oxoethyl]piperazine-1-carboxamide
CID 35676181
N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-2,2-diphenylacetamide
CID 71897392
3-(2,3-dihydro-1-benzofuran-2-ylmethylamino)-3-oxopropanoic acid
CID 62229922
(2R,6S)-N-[[(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-methyl-6-phenylmorpholine-4-carboxamide
CID 124866660
4-benzyl-N-phenylpiperidine-1-carboxamide
CID 5064762
N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-2-oxo-2-piperazin-1-ylacetamide
CID 62233747
3-benzyl-N-[(1-cyclopropyl-5-oxopyrrolidin-3-yl)methyl]pyrrolidine-1-carboxamide
CID 136521896
N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-2-pyridin-4-ylpyrrolidine-1-carboxamide
CID 87007306
5-(2,3-dihydro-1-benzofuran-2-ylmethylamino)furan-2-carboxylic acid
CID 62233383
N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-3,3-diphenylpropanamide
CID 55613114

Frequently Asked Questions

What is the IUPAC name of 4-benzyl-N-[[(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl]piperidine-1-carboxamide?
The IUPAC name of 4-benzyl-N-[[(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl]piperidine-1-carboxamide (CID 35673121) is 4-benzyl-N-[[(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl]piperidine-1-carboxamide.
What is the SMILES notation for 4-benzyl-N-[[(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl]piperidine-1-carboxamide?
The canonical SMILES for 4-benzyl-N-[[(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl]piperidine-1-carboxamide is O=C(NC[C@H]1Cc2ccccc2O1)N1CCC(Cc2ccccc2)CC1.
What is the InChIKey of 4-benzyl-N-[[(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl]piperidine-1-carboxamide?
The InChIKey is PUXYBUKSJWJJPD-HXUWFJFHSA-N. The full InChI is InChI=1S/C22H26N2O2/c25-22(23-16-20-15-19-8-4-5-9-21(19)26-20)24-12-10-18(11-13-24)14-17-6-2-1-3-7-17/h1-9,18,20H,10-16H2,(H,23,25)/t20-/m1/s1.
What are the key properties of 4-benzyl-N-[[(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl]piperidine-1-carboxamide?
4-benzyl-N-[[(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl]piperidine-1-carboxamide has a molecular weight of 350.46 g/mol, XLogP of 3.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-N-[[(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl]piperidine-1-carboxamide is sourced from PubChem (CID 35673121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).