N-[1-[2-(phenoxymethyl)benzoyl]piperidin-4-yl]benzamide

C26H26N2O3 — CID 18131786

IUPACN-[1-[2-(phenoxymethyl)benzoyl]piperidin-4-yl]benzamide
SMILESO=C(NC1CCN(C(=O)c2ccccc2COc2ccccc2)CC1)c1ccccc1
InChIInChI=1S/C26H26N2O3/c29-25(20-9-3-1-4-10-20)27-22-15-17-28(18-16-22)26(30)24-14-8-7-11-21(24)19-31-23-12-5-2-6-13-23/h1-14,22H,15-19H2,(H,27,29)
InChIKeyOALGIIJFZLYMGY-UHFFFAOYSA-N
MW414.50 g/mol
LogP4.30
Rot. Bonds6

About N-[1-[2-(phenoxymethyl)benzoyl]piperidin-4-yl]benzamide

N-[1-[2-(phenoxymethyl)benzoyl]piperidin-4-yl]benzamide (PubChem CID 18131786) has the molecular formula C26H26N2O3 and a molecular weight of 414.50 g/mol. Its IUPAC name is N-[1-[2-(phenoxymethyl)benzoyl]piperidin-4-yl]benzamide.

Molecular Properties

Compound NameN-[1-[2-(phenoxymethyl)benzoyl]piperidin-4-yl]benzamide
PubChem CID18131786
Molecular FormulaC26H26N2O3
Molecular Weight414.50 g/mol
Exact Mass414.19
IUPAC NameN-[1-[2-(phenoxymethyl)benzoyl]piperidin-4-yl]benzamide
SMILESO=C(NC1CCN(C(=O)c2ccccc2COc2ccccc2)CC1)c1ccccc1
InChIInChI=1S/C26H26N2O3/c29-25(20-9-3-1-4-10-20)27-22-15-17-28(18-16-22)26(30)24-14-8-7-11-21(24)19-31-23-12-5-2-6-13-23/h1-14,22H,15-19H2,(H,27,29)
InChIKeyOALGIIJFZLYMGY-UHFFFAOYSA-N
XLogP4.30
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.50
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(methylaminomethyl)piperidin-1-yl]-[2-(phenoxymethyl)phenyl]methanone;hydrochloride
CID 119544892
N-[1-(2-phenoxypyridine-3-carbonyl)piperidin-4-yl]benzamide
CID 2810680
cyclopropyl-[4-[2-(phenoxymethyl)benzoyl]piperazin-1-yl]methanone
CID 17411575
[(3R)-3-hydroxypyrrolidin-1-yl]-[2-(phenoxymethyl)phenyl]methanone
CID 111561150
N-[1-(furan-2-carbonyl)piperidin-4-yl]-4-phenylmethoxybenzamide
CID 16606665
2-(phenoxymethyl)-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119451945
N-[1-[2-[(2-phenoxyacetyl)amino]acetyl]piperidin-4-yl]benzamide
CID 17432373
4-hydroxy-1-[2-(phenoxymethyl)benzoyl]piperidine-4-carboxylic acid
CID 119251922
N-[1-(4-ethoxybenzoyl)piperidin-4-yl]-3-phenylmethoxybenzamide
CID 112804050
4-[(2-chlorophenyl)methoxy]-N-(1-methylpiperidin-4-yl)benzamide
CID 56919566
4-ethoxy-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide
CID 108551846
N-(1-benzoylpiperidin-4-yl)-4-phenylbenzamide
CID 108549483

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(phenoxymethyl)benzoyl]piperidin-4-yl]benzamide?
The IUPAC name of N-[1-[2-(phenoxymethyl)benzoyl]piperidin-4-yl]benzamide (CID 18131786) is N-[1-[2-(phenoxymethyl)benzoyl]piperidin-4-yl]benzamide.
What is the SMILES notation for N-[1-[2-(phenoxymethyl)benzoyl]piperidin-4-yl]benzamide?
The canonical SMILES for N-[1-[2-(phenoxymethyl)benzoyl]piperidin-4-yl]benzamide is O=C(NC1CCN(C(=O)c2ccccc2COc2ccccc2)CC1)c1ccccc1.
What is the InChIKey of N-[1-[2-(phenoxymethyl)benzoyl]piperidin-4-yl]benzamide?
The InChIKey is OALGIIJFZLYMGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N2O3/c29-25(20-9-3-1-4-10-20)27-22-15-17-28(18-16-22)26(30)24-14-8-7-11-21(24)19-31-23-12-5-2-6-13-23/h1-14,22H,15-19H2,(H,27,29).
What are the key properties of N-[1-[2-(phenoxymethyl)benzoyl]piperidin-4-yl]benzamide?
N-[1-[2-(phenoxymethyl)benzoyl]piperidin-4-yl]benzamide has a molecular weight of 414.50 g/mol, XLogP of 4.30, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(phenoxymethyl)benzoyl]piperidin-4-yl]benzamide is sourced from PubChem (CID 18131786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).