4-benzoyl-N-[2-(2-methoxyethoxy)phenyl]piperidine-1-carboxamide

C22H26N2O4 — CID 47493503

IUPAC4-benzoyl-N-[2-(2-methoxyethoxy)phenyl]piperidine-1-carboxamide
SMILESCOCCOc1ccccc1NC(=O)N1CCC(C(=O)c2ccccc2)CC1
InChIInChI=1S/C22H26N2O4/c1-27-15-16-28-20-10-6-5-9-19(20)23-22(26)24-13-11-18(12-14-24)21(25)17-7-3-2-4-8-17/h2-10,18H,11-16H2,1H3,(H,23,26)
InChIKeyBSPGEEWEHDCNBI-UHFFFAOYSA-N
MW382.46 g/mol
LogP3.84
Rot. Bonds7

About 4-benzoyl-N-[2-(2-methoxyethoxy)phenyl]piperidine-1-carboxamide

4-benzoyl-N-[2-(2-methoxyethoxy)phenyl]piperidine-1-carboxamide (PubChem CID 47493503) has the molecular formula C22H26N2O4 and a molecular weight of 382.46 g/mol. Its IUPAC name is 4-benzoyl-N-[2-(2-methoxyethoxy)phenyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name4-benzoyl-N-[2-(2-methoxyethoxy)phenyl]piperidine-1-carboxamide
PubChem CID47493503
Molecular FormulaC22H26N2O4
Molecular Weight382.46 g/mol
Exact Mass382.19
IUPAC Name4-benzoyl-N-[2-(2-methoxyethoxy)phenyl]piperidine-1-carboxamide
SMILESCOCCOc1ccccc1NC(=O)N1CCC(C(=O)c2ccccc2)CC1
InChIInChI=1S/C22H26N2O4/c1-27-15-16-28-20-10-6-5-9-19(20)23-22(26)24-13-11-18(12-14-24)21(25)17-7-3-2-4-8-17/h2-10,18H,11-16H2,1H3,(H,23,26)
InChIKeyBSPGEEWEHDCNBI-UHFFFAOYSA-N
XLogP3.84
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.46
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-[[2-(3-methoxypropoxy)phenyl]carbamoyl]pyrrolidine-3-carboxylic acid
CID 122077530
N-[2-(3-methoxypropoxy)phenyl]pyrrolidine-1-carboxamide
CID 47373598
N-[2-(2-methoxyethoxy)phenyl]-3-phenylpiperazine-1-carboxamide
CID 72938413
1-N-(2-butoxyphenyl)-4-N,4-N-dimethylpiperidine-1,4-dicarboxamide
CID 87035683
1-[[2-(cyclopropylmethoxy)phenyl]carbamoyl]piperidine-4-carboxylic acid
CID 122085447
1-[[3-chloro-2-(2-methoxyethoxy)phenyl]carbamoyl]piperidine-4-carboxylic acid
CID 122078161
N-[2-(2-methoxyethoxy)phenyl]-4-(3-methylphenyl)piperazine-1-carboxamide
CID 47493667
N-(2-methoxyphenyl)-4-(piperidine-1-carbonyl)piperidine-1-carboxamide
CID 27869689
(3S,4S)-3,4-dihydroxy-N-[2-(3-phenylpropoxy)phenyl]piperidine-1-carboxamide
CID 118761290
N-[2-(2-methoxyethoxy)-4-methylphenyl]pyrrolidine-1-carboxamide
CID 47262655
1-[2-(2-methoxyethoxy)benzoyl]piperidine-4-carboxylic acid
CID 54793768
3-(methoxymethyl)-N-(2-propoxyphenyl)azetidine-1-carboxamide
CID 126831370

Frequently Asked Questions

What is the IUPAC name of 4-benzoyl-N-[2-(2-methoxyethoxy)phenyl]piperidine-1-carboxamide?
The IUPAC name of 4-benzoyl-N-[2-(2-methoxyethoxy)phenyl]piperidine-1-carboxamide (CID 47493503) is 4-benzoyl-N-[2-(2-methoxyethoxy)phenyl]piperidine-1-carboxamide.
What is the SMILES notation for 4-benzoyl-N-[2-(2-methoxyethoxy)phenyl]piperidine-1-carboxamide?
The canonical SMILES for 4-benzoyl-N-[2-(2-methoxyethoxy)phenyl]piperidine-1-carboxamide is COCCOc1ccccc1NC(=O)N1CCC(C(=O)c2ccccc2)CC1.
What is the InChIKey of 4-benzoyl-N-[2-(2-methoxyethoxy)phenyl]piperidine-1-carboxamide?
The InChIKey is BSPGEEWEHDCNBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O4/c1-27-15-16-28-20-10-6-5-9-19(20)23-22(26)24-13-11-18(12-14-24)21(25)17-7-3-2-4-8-17/h2-10,18H,11-16H2,1H3,(H,23,26).
What are the key properties of 4-benzoyl-N-[2-(2-methoxyethoxy)phenyl]piperidine-1-carboxamide?
4-benzoyl-N-[2-(2-methoxyethoxy)phenyl]piperidine-1-carboxamide has a molecular weight of 382.46 g/mol, XLogP of 3.84, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzoyl-N-[2-(2-methoxyethoxy)phenyl]piperidine-1-carboxamide is sourced from PubChem (CID 47493503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).