2-[2-(4-phenylmethoxypiperidine-1-carbonyl)phenoxy]acetamide

C21H24N2O4 — CID 120660781

IUPAC2-[2-(4-phenylmethoxypiperidine-1-carbonyl)phenoxy]acetamide
SMILESNC(=O)COc1ccccc1C(=O)N1CCC(OCc2ccccc2)CC1
InChIInChI=1S/C21H24N2O4/c22-20(24)15-27-19-9-5-4-8-18(19)21(25)23-12-10-17(11-13-23)26-14-16-6-2-1-3-7-16/h1-9,17H,10-15H2,(H2,22,24)
InChIKeyHEMRCPSQVPOXKS-UHFFFAOYSA-N
MW368.43 g/mol
LogP2.37
Rot. Bonds7

About 2-[2-(4-phenylmethoxypiperidine-1-carbonyl)phenoxy]acetamide

2-[2-(4-phenylmethoxypiperidine-1-carbonyl)phenoxy]acetamide (PubChem CID 120660781) has the molecular formula C21H24N2O4 and a molecular weight of 368.43 g/mol. Its IUPAC name is 2-[2-(4-phenylmethoxypiperidine-1-carbonyl)phenoxy]acetamide.

Molecular Properties

Compound Name2-[2-(4-phenylmethoxypiperidine-1-carbonyl)phenoxy]acetamide
PubChem CID120660781
Molecular FormulaC21H24N2O4
Molecular Weight368.43 g/mol
Exact Mass368.17
IUPAC Name2-[2-(4-phenylmethoxypiperidine-1-carbonyl)phenoxy]acetamide
SMILESNC(=O)COc1ccccc1C(=O)N1CCC(OCc2ccccc2)CC1
InChIInChI=1S/C21H24N2O4/c22-20(24)15-27-19-9-5-4-8-18(19)21(25)23-12-10-17(11-13-23)26-14-16-6-2-1-3-7-16/h1-9,17H,10-15H2,(H2,22,24)
InChIKeyHEMRCPSQVPOXKS-UHFFFAOYSA-N
XLogP2.37
TPSA81.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.43
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,N-dimethyl-2-[2-(4-phenylmethoxypiperidine-1-carbonyl)phenoxy]acetamide
CID 46417857
2-[4-(4-phenylmethoxypiperidine-1-carbonyl)phenoxy]acetamide
CID 51278709
2-[2-[4-(cyclopropylmethylamino)piperidine-1-carbonyl]phenoxy]acetamide
CID 119625161
(2,3-dichlorophenyl)-(4-phenylmethoxypiperidin-1-yl)methanone
CID 55460870
(4-aminophenyl)-(4-phenylmethoxypiperidin-1-yl)methanone
CID 119697040
2-[2-[4-[3-(trifluoromethyl)phenoxy]piperidine-1-carbonyl]phenoxy]acetamide
CID 67169798
2-[2-(3,9-diazabicyclo[4.2.1]nonane-3-carbonyl)phenoxy]acetamide;hydrochloride
CID 119639113
[4-(aminomethyl)phenyl]-(4-phenylmethoxypiperidin-1-yl)methanone;hydrochloride
CID 119275315
4-[4-(4-phenylmethoxypiperidine-1-carbonyl)phenoxy]benzamide
CID 56545792
(3-ethoxy-2-pyridinyl)-(4-phenylmethoxypiperidin-1-yl)methanone
CID 71863399
2-[2-(4-ethyl-4-hydroxypiperidine-1-carbonyl)phenoxy]acetamide
CID 119138250
(4-phenylmethoxypiperidin-1-yl)-(1,3-thiazol-4-yl)methanone
CID 70762006

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-phenylmethoxypiperidine-1-carbonyl)phenoxy]acetamide?
The IUPAC name of 2-[2-(4-phenylmethoxypiperidine-1-carbonyl)phenoxy]acetamide (CID 120660781) is 2-[2-(4-phenylmethoxypiperidine-1-carbonyl)phenoxy]acetamide.
What is the SMILES notation for 2-[2-(4-phenylmethoxypiperidine-1-carbonyl)phenoxy]acetamide?
The canonical SMILES for 2-[2-(4-phenylmethoxypiperidine-1-carbonyl)phenoxy]acetamide is NC(=O)COc1ccccc1C(=O)N1CCC(OCc2ccccc2)CC1.
What is the InChIKey of 2-[2-(4-phenylmethoxypiperidine-1-carbonyl)phenoxy]acetamide?
The InChIKey is HEMRCPSQVPOXKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O4/c22-20(24)15-27-19-9-5-4-8-18(19)21(25)23-12-10-17(11-13-23)26-14-16-6-2-1-3-7-16/h1-9,17H,10-15H2,(H2,22,24).
What are the key properties of 2-[2-(4-phenylmethoxypiperidine-1-carbonyl)phenoxy]acetamide?
2-[2-(4-phenylmethoxypiperidine-1-carbonyl)phenoxy]acetamide has a molecular weight of 368.43 g/mol, XLogP of 2.37, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-phenylmethoxypiperidine-1-carbonyl)phenoxy]acetamide is sourced from PubChem (CID 120660781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).