4-[(2-chlorophenyl)methoxy]-N-[2-(piperidine-1-carbonyl)phenyl]benzamide

C26H25ClN2O3 — CID 19916445

IUPAC4-[(2-chlorophenyl)methoxy]-N-[2-(piperidine-1-carbonyl)phenyl]benzamide
SMILESO=C(Nc1ccccc1C(=O)N1CCCCC1)c1ccc(OCc2ccccc2Cl)cc1
InChIInChI=1S/C26H25ClN2O3/c27-23-10-4-2-8-20(23)18-32-21-14-12-19(13-15-21)25(30)28-24-11-5-3-9-22(24)26(31)29-16-6-1-7-17-29/h2-5,8-15H,1,6-7,16-18H2,(H,28,30)
InChIKeyLCHKXDKTKRGGQK-UHFFFAOYSA-N
MW448.95 g/mol
LogP5.80
Rot. Bonds6

About 4-[(2-chlorophenyl)methoxy]-N-[2-(piperidine-1-carbonyl)phenyl]benzamide

4-[(2-chlorophenyl)methoxy]-N-[2-(piperidine-1-carbonyl)phenyl]benzamide (PubChem CID 19916445) has the molecular formula C26H25ClN2O3 and a molecular weight of 448.95 g/mol. Its IUPAC name is 4-[(2-chlorophenyl)methoxy]-N-[2-(piperidine-1-carbonyl)phenyl]benzamide.

Molecular Properties

Compound Name4-[(2-chlorophenyl)methoxy]-N-[2-(piperidine-1-carbonyl)phenyl]benzamide
PubChem CID19916445
Molecular FormulaC26H25ClN2O3
Molecular Weight448.95 g/mol
Exact Mass448.16
IUPAC Name4-[(2-chlorophenyl)methoxy]-N-[2-(piperidine-1-carbonyl)phenyl]benzamide
SMILESO=C(Nc1ccccc1C(=O)N1CCCCC1)c1ccc(OCc2ccccc2Cl)cc1
InChIInChI=1S/C26H25ClN2O3/c27-23-10-4-2-8-20(23)18-32-21-14-12-19(13-15-21)25(30)28-24-11-5-3-9-22(24)26(31)29-16-6-1-7-17-29/h2-5,8-15H,1,6-7,16-18H2,(H,28,30)
InChIKeyLCHKXDKTKRGGQK-UHFFFAOYSA-N
XLogP5.80
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500448.95
LogP ≤ 55.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-N,4-N-bis[2-(azepane-1-carbonyl)phenyl]benzene-1,4-dicarboxamide
CID 4938376
2-[[4-[(2-chlorophenyl)carbamoyl]phenoxy]methyl]benzoic acid
CID 20986440
4-pentoxy-N-[2-(pyrrolidine-1-carbonyl)phenyl]benzamide
CID 4935150
N-[2-(azepane-1-carbonyl)phenyl]-2-chlorobenzamide
CID 2985638
3-chloro-4-ethoxy-N-[2-(piperidine-1-carbonyl)phenyl]benzamide
CID 100774361
4-[(2-chlorophenyl)methoxy]-N-[2-(trifluoromethyl)phenyl]benzamide
CID 8813320
3-[(2-chlorophenyl)methoxy]-N-[4-(piperidine-1-carbonyl)phenyl]benzamide
CID 100750028
4-piperidin-1-yl-N-[2-(pyrrolidine-1-carbonyl)phenyl]benzamide
CID 21367427
4-[(2-chlorophenyl)methoxy]-N-phenylbenzamide
CID 8813243
3-(2-chlorophenyl)-N-[2-(piperidine-1-carbonyl)phenyl]propanamide
CID 17179010
N-[[2-(azepane-1-carbonyl)phenyl]carbamothioyl]-4-(2-phenoxyethoxy)benzamide
CID 4953102
2-(4-acetylphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide
CID 26905349

Frequently Asked Questions

What is the IUPAC name of 4-[(2-chlorophenyl)methoxy]-N-[2-(piperidine-1-carbonyl)phenyl]benzamide?
The IUPAC name of 4-[(2-chlorophenyl)methoxy]-N-[2-(piperidine-1-carbonyl)phenyl]benzamide (CID 19916445) is 4-[(2-chlorophenyl)methoxy]-N-[2-(piperidine-1-carbonyl)phenyl]benzamide.
What is the SMILES notation for 4-[(2-chlorophenyl)methoxy]-N-[2-(piperidine-1-carbonyl)phenyl]benzamide?
The canonical SMILES for 4-[(2-chlorophenyl)methoxy]-N-[2-(piperidine-1-carbonyl)phenyl]benzamide is O=C(Nc1ccccc1C(=O)N1CCCCC1)c1ccc(OCc2ccccc2Cl)cc1.
What is the InChIKey of 4-[(2-chlorophenyl)methoxy]-N-[2-(piperidine-1-carbonyl)phenyl]benzamide?
The InChIKey is LCHKXDKTKRGGQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25ClN2O3/c27-23-10-4-2-8-20(23)18-32-21-14-12-19(13-15-21)25(30)28-24-11-5-3-9-22(24)26(31)29-16-6-1-7-17-29/h2-5,8-15H,1,6-7,16-18H2,(H,28,30).
What are the key properties of 4-[(2-chlorophenyl)methoxy]-N-[2-(piperidine-1-carbonyl)phenyl]benzamide?
4-[(2-chlorophenyl)methoxy]-N-[2-(piperidine-1-carbonyl)phenyl]benzamide has a molecular weight of 448.95 g/mol, XLogP of 5.80, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-chlorophenyl)methoxy]-N-[2-(piperidine-1-carbonyl)phenyl]benzamide is sourced from PubChem (CID 19916445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).