N-benzyl-N-[1-(2-methoxyphenyl)propan-2-yl]piperidine-3-carboxamide

C23H30N2O2 — CID 119309205

IUPACN-benzyl-N-[1-(2-methoxyphenyl)propan-2-yl]piperidine-3-carboxamide
SMILESCOc1ccccc1CC(C)N(Cc1ccccc1)C(=O)C1CCCNC1
InChIInChI=1S/C23H30N2O2/c1-18(15-20-11-6-7-13-22(20)27-2)25(17-19-9-4-3-5-10-19)23(26)21-12-8-14-24-16-21/h3-7,9-11,13,18,21,24H,8,12,14-17H2,1-2H3
InChIKeyJUTYAWRRBYAMPO-UHFFFAOYSA-N
MW366.50 g/mol
LogP3.65
Rot. Bonds7

About N-benzyl-N-[1-(2-methoxyphenyl)propan-2-yl]piperidine-3-carboxamide

N-benzyl-N-[1-(2-methoxyphenyl)propan-2-yl]piperidine-3-carboxamide (PubChem CID 119309205) has the molecular formula C23H30N2O2 and a molecular weight of 366.50 g/mol. Its IUPAC name is N-benzyl-N-[1-(2-methoxyphenyl)propan-2-yl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN-benzyl-N-[1-(2-methoxyphenyl)propan-2-yl]piperidine-3-carboxamide
PubChem CID119309205
Molecular FormulaC23H30N2O2
Molecular Weight366.50 g/mol
Exact Mass366.23
IUPAC NameN-benzyl-N-[1-(2-methoxyphenyl)propan-2-yl]piperidine-3-carboxamide
SMILESCOc1ccccc1CC(C)N(Cc1ccccc1)C(=O)C1CCCNC1
InChIInChI=1S/C23H30N2O2/c1-18(15-20-11-6-7-13-22(20)27-2)25(17-19-9-4-3-5-10-19)23(26)21-12-8-14-24-16-21/h3-7,9-11,13,18,21,24H,8,12,14-17H2,1-2H3
InChIKeyJUTYAWRRBYAMPO-UHFFFAOYSA-N
XLogP3.65
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.50
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpiperidine-3-carboxamide
CID 65487251
(3R)-N-benzyl-N-[(2R)-1-(2-methoxyphenyl)propan-2-yl]oxolane-3-carboxamide
CID 52849838
(3S)-N-[(2-methoxyphenyl)methyl]-N-methylpiperidine-3-carboxamide
CID 81128624
2-amino-N-benzyl-N-[1-(2-methoxyphenyl)propan-2-yl]acetamide;hydrochloride
CID 119309200
N,N-dibenzylpiperidine-3-carboxamide;hydrochloride
CID 119261732
(3S)-N-benzyl-N-propylpiperidine-3-carboxamide
CID 81123216
N-benzyl-N-propylpiperidine-3-carboxamide
CID 43588657
N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)piperidine-3-carboxamide;hydrochloride
CID 119268854
N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpiperazine-2-carboxamide
CID 65486341
N-benzyl-3,4,5-trimethoxy-N-[(2R)-1-(2-methoxyphenyl)propan-2-yl]benzamide
CID 52501698
N-[(3-chlorophenyl)methyl]-N-propan-2-ylpiperidine-3-carboxamide;hydrochloride
CID 119289277
(3S)-N-benzyl-N-[2-(dimethylamino)ethyl]piperidine-3-carboxamide
CID 81126278

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-[1-(2-methoxyphenyl)propan-2-yl]piperidine-3-carboxamide?
The IUPAC name of N-benzyl-N-[1-(2-methoxyphenyl)propan-2-yl]piperidine-3-carboxamide (CID 119309205) is N-benzyl-N-[1-(2-methoxyphenyl)propan-2-yl]piperidine-3-carboxamide.
What is the SMILES notation for N-benzyl-N-[1-(2-methoxyphenyl)propan-2-yl]piperidine-3-carboxamide?
The canonical SMILES for N-benzyl-N-[1-(2-methoxyphenyl)propan-2-yl]piperidine-3-carboxamide is COc1ccccc1CC(C)N(Cc1ccccc1)C(=O)C1CCCNC1.
What is the InChIKey of N-benzyl-N-[1-(2-methoxyphenyl)propan-2-yl]piperidine-3-carboxamide?
The InChIKey is JUTYAWRRBYAMPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O2/c1-18(15-20-11-6-7-13-22(20)27-2)25(17-19-9-4-3-5-10-19)23(26)21-12-8-14-24-16-21/h3-7,9-11,13,18,21,24H,8,12,14-17H2,1-2H3.
What are the key properties of N-benzyl-N-[1-(2-methoxyphenyl)propan-2-yl]piperidine-3-carboxamide?
N-benzyl-N-[1-(2-methoxyphenyl)propan-2-yl]piperidine-3-carboxamide has a molecular weight of 366.50 g/mol, XLogP of 3.65, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-[1-(2-methoxyphenyl)propan-2-yl]piperidine-3-carboxamide is sourced from PubChem (CID 119309205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).