N-(1-benzylpiperidin-4-yl)-2-methyl-5-phenylfuran-3-carboxamide

C24H26N2O2 — CID 2742881

IUPACN-(1-benzylpiperidin-4-yl)-2-methyl-5-phenylfuran-3-carboxamide
SMILESCc1oc(-c2ccccc2)cc1C(=O)NC1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C24H26N2O2/c1-18-22(16-23(28-18)20-10-6-3-7-11-20)24(27)25-21-12-14-26(15-13-21)17-19-8-4-2-5-9-19/h2-11,16,21H,12-15,17H2,1H3,(H,25,27)
InChIKeySJOVZWDBFVPZMM-UHFFFAOYSA-N
MW374.48 g/mol
LogP4.65
Rot. Bonds5

About N-(1-benzylpiperidin-4-yl)-2-methyl-5-phenylfuran-3-carboxamide

N-(1-benzylpiperidin-4-yl)-2-methyl-5-phenylfuran-3-carboxamide (PubChem CID 2742881) has the molecular formula C24H26N2O2 and a molecular weight of 374.48 g/mol. Its IUPAC name is N-(1-benzylpiperidin-4-yl)-2-methyl-5-phenylfuran-3-carboxamide.

Molecular Properties

Compound NameN-(1-benzylpiperidin-4-yl)-2-methyl-5-phenylfuran-3-carboxamide
PubChem CID2742881
Molecular FormulaC24H26N2O2
Molecular Weight374.48 g/mol
Exact Mass374.20
IUPAC NameN-(1-benzylpiperidin-4-yl)-2-methyl-5-phenylfuran-3-carboxamide
SMILESCc1oc(-c2ccccc2)cc1C(=O)NC1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C24H26N2O2/c1-18-22(16-23(28-18)20-10-6-3-7-11-20)24(27)25-21-12-14-26(15-13-21)17-19-8-4-2-5-9-19/h2-11,16,21H,12-15,17H2,1H3,(H,25,27)
InChIKeySJOVZWDBFVPZMM-UHFFFAOYSA-N
XLogP4.65
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.48
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(dimethylamino)propyl]-2-phenoxybenzamide
CID 1928169
5-[3-(tert-butylcarbamoyl)phenyl]-2-(4-fluorophenyl)-N-methyl-1-benzofuran-3-carboxamide
CID 53468653
[3-(3-carbamoyl-5-methylfuran-2-yl)phenyl] N-(6-phenylhexyl)carbamate
CID 46916519
4-[(3-Acetyl-phenyl)-(8-furan-3-ylmethyl-8-aza-bicyclo[3.2.1]oct-3-ylidene)-methyl]-N-ethyl-benzamide
CID 44395423
4-[(4-Acetyl-phenyl)-(8-furan-3-ylmethyl-8-aza-bicyclo[3.2.1]oct-3-ylidene)-methyl]-N-ethyl-benzamide
CID 44395474
[3-(3-carbamoyl-5-methylfuran-2-yl)phenyl] N-[2-(4-phenylpiperazin-1-yl)ethyl]carbamate
CID 155535169
N-Benzyl-3-(5-methyl-furan-2-yl)-propionamide
CID 827173
(4-Benzylpiperidin-1-yl)-(2,5-dimethylfuran-3-yl)methanone
CID 1245621
N-(1-benzyl-4-piperidinyl)-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-carboxamide
CID 2738398
N-(1-benzylpiperidin-4-yl)-2-ethoxybenzamide
CID 8181355
[1-(3-Furoyl)-3-piperidinyl](3-isopropoxyphenyl)methanone
CID 16189901
3,4-dihydro-1H-isoquinolin-2-yl-(2,5-dimethylfuran-3-yl)methanone
CID 18108187

Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpiperidin-4-yl)-2-methyl-5-phenylfuran-3-carboxamide?
The IUPAC name of N-(1-benzylpiperidin-4-yl)-2-methyl-5-phenylfuran-3-carboxamide (CID 2742881) is N-(1-benzylpiperidin-4-yl)-2-methyl-5-phenylfuran-3-carboxamide.
What is the SMILES notation for N-(1-benzylpiperidin-4-yl)-2-methyl-5-phenylfuran-3-carboxamide?
The canonical SMILES for N-(1-benzylpiperidin-4-yl)-2-methyl-5-phenylfuran-3-carboxamide is Cc1oc(-c2ccccc2)cc1C(=O)NC1CCN(Cc2ccccc2)CC1.
What is the InChIKey of N-(1-benzylpiperidin-4-yl)-2-methyl-5-phenylfuran-3-carboxamide?
The InChIKey is SJOVZWDBFVPZMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O2/c1-18-22(16-23(28-18)20-10-6-3-7-11-20)24(27)25-21-12-14-26(15-13-21)17-19-8-4-2-5-9-19/h2-11,16,21H,12-15,17H2,1H3,(H,25,27).
What are the key properties of N-(1-benzylpiperidin-4-yl)-2-methyl-5-phenylfuran-3-carboxamide?
N-(1-benzylpiperidin-4-yl)-2-methyl-5-phenylfuran-3-carboxamide has a molecular weight of 374.48 g/mol, XLogP of 4.65, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpiperidin-4-yl)-2-methyl-5-phenylfuran-3-carboxamide is sourced from PubChem (CID 2742881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).