4-[[2-(2-methoxyphenoxy)acetyl]amino]-N-phenylpiperidine-1-carboxamide

C21H25N3O4 — CID 51324414

IUPAC4-[[2-(2-methoxyphenoxy)acetyl]amino]-N-phenylpiperidine-1-carboxamide
SMILESCOc1ccccc1OCC(=O)NC1CCN(C(=O)Nc2ccccc2)CC1
InChIInChI=1S/C21H25N3O4/c1-27-18-9-5-6-10-19(18)28-15-20(25)22-17-11-13-24(14-12-17)21(26)23-16-7-3-2-4-8-16/h2-10,17H,11-15H2,1H3,(H,22,25)(H,23,26)
InChIKeyILHSFBQNKFTSQM-UHFFFAOYSA-N
MW383.45 g/mol
LogP2.89
Rot. Bonds6

About 4-[[2-(2-methoxyphenoxy)acetyl]amino]-N-phenylpiperidine-1-carboxamide

4-[[2-(2-methoxyphenoxy)acetyl]amino]-N-phenylpiperidine-1-carboxamide (PubChem CID 51324414) has the molecular formula C21H25N3O4 and a molecular weight of 383.45 g/mol. Its IUPAC name is 4-[[2-(2-methoxyphenoxy)acetyl]amino]-N-phenylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-[[2-(2-methoxyphenoxy)acetyl]amino]-N-phenylpiperidine-1-carboxamide
PubChem CID51324414
Molecular FormulaC21H25N3O4
Molecular Weight383.45 g/mol
Exact Mass383.18
IUPAC Name4-[[2-(2-methoxyphenoxy)acetyl]amino]-N-phenylpiperidine-1-carboxamide
SMILESCOc1ccccc1OCC(=O)NC1CCN(C(=O)Nc2ccccc2)CC1
InChIInChI=1S/C21H25N3O4/c1-27-18-9-5-6-10-19(18)28-15-20(25)22-17-11-13-24(14-12-17)21(26)23-16-7-3-2-4-8-16/h2-10,17H,11-15H2,1H3,(H,22,25)(H,23,26)
InChIKeyILHSFBQNKFTSQM-UHFFFAOYSA-N
XLogP2.89
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.45
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[2-(2-chlorophenoxy)acetyl]amino]-N-phenylpiperidine-1-carboxamide
CID 46700417
4-[[2-(2-fluorophenoxy)acetyl]amino]-N-phenylpiperidine-1-carboxamide
CID 51324417
4-[[2-(2-methoxyphenoxy)acetyl]amino]-N-propan-2-ylpiperidine-1-carboxamide
CID 110822362
N-[1-(2-methoxybenzoyl)piperidin-4-yl]-2-(2-methoxyphenoxy)acetamide
CID 108556653
2-methoxy-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]acetamide
CID 108557222
N-phenyl-4-[[2-(4-propoxyphenoxy)acetyl]amino]piperidine-1-carboxamide
CID 55501742
N-[1-(4-tert-butylbenzoyl)piperidin-4-yl]-2-(2-methoxyphenoxy)acetamide
CID 108556694
[2-oxo-2-[4-(phenylcarbamoyl)piperazin-1-yl]ethyl] 2-(2-methoxyphenoxy)acetate
CID 27237321
2-(2-methoxyphenoxy)-N-piperidin-4-ylacetamide
CID 28810945
2-(3,4-dimethylphenoxy)-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]acetamide
CID 108553023
2-(2-methoxyphenoxy)-N-[1-(2,3,4-trifluorobenzoyl)piperidin-4-yl]acetamide
CID 108556719
4-(4-phenoxybutanoylamino)-N-phenylpiperidine-1-carboxamide
CID 51324376

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(2-methoxyphenoxy)acetyl]amino]-N-phenylpiperidine-1-carboxamide?
The IUPAC name of 4-[[2-(2-methoxyphenoxy)acetyl]amino]-N-phenylpiperidine-1-carboxamide (CID 51324414) is 4-[[2-(2-methoxyphenoxy)acetyl]amino]-N-phenylpiperidine-1-carboxamide.
What is the SMILES notation for 4-[[2-(2-methoxyphenoxy)acetyl]amino]-N-phenylpiperidine-1-carboxamide?
The canonical SMILES for 4-[[2-(2-methoxyphenoxy)acetyl]amino]-N-phenylpiperidine-1-carboxamide is COc1ccccc1OCC(=O)NC1CCN(C(=O)Nc2ccccc2)CC1.
What is the InChIKey of 4-[[2-(2-methoxyphenoxy)acetyl]amino]-N-phenylpiperidine-1-carboxamide?
The InChIKey is ILHSFBQNKFTSQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O4/c1-27-18-9-5-6-10-19(18)28-15-20(25)22-17-11-13-24(14-12-17)21(26)23-16-7-3-2-4-8-16/h2-10,17H,11-15H2,1H3,(H,22,25)(H,23,26).
What are the key properties of 4-[[2-(2-methoxyphenoxy)acetyl]amino]-N-phenylpiperidine-1-carboxamide?
4-[[2-(2-methoxyphenoxy)acetyl]amino]-N-phenylpiperidine-1-carboxamide has a molecular weight of 383.45 g/mol, XLogP of 2.89, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(2-methoxyphenoxy)acetyl]amino]-N-phenylpiperidine-1-carboxamide is sourced from PubChem (CID 51324414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).