3,5-dichloro-N-[4-(piperidin-4-ylcarbamoyl)phenyl]benzamide

C19H19Cl2N3O2 — CID 119386610

IUPAC3,5-dichloro-N-[4-(piperidin-4-ylcarbamoyl)phenyl]benzamide
SMILESO=C(Nc1ccc(C(=O)NC2CCNCC2)cc1)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C19H19Cl2N3O2/c20-14-9-13(10-15(21)11-14)19(26)23-16-3-1-12(2-4-16)18(25)24-17-5-7-22-8-6-17/h1-4,9-11,17,22H,5-8H2,(H,23,26)(H,24,25)
InChIKeyUFCQMVZZVINBLS-UHFFFAOYSA-N
MW392.29 g/mol
LogP3.73
Rot. Bonds4

About 3,5-dichloro-N-[4-(piperidin-4-ylcarbamoyl)phenyl]benzamide

3,5-dichloro-N-[4-(piperidin-4-ylcarbamoyl)phenyl]benzamide (PubChem CID 119386610) has the molecular formula C19H19Cl2N3O2 and a molecular weight of 392.29 g/mol. Its IUPAC name is 3,5-dichloro-N-[4-(piperidin-4-ylcarbamoyl)phenyl]benzamide.

Molecular Properties

Compound Name3,5-dichloro-N-[4-(piperidin-4-ylcarbamoyl)phenyl]benzamide
PubChem CID119386610
Molecular FormulaC19H19Cl2N3O2
Molecular Weight392.29 g/mol
Exact Mass391.09
IUPAC Name3,5-dichloro-N-[4-(piperidin-4-ylcarbamoyl)phenyl]benzamide
SMILESO=C(Nc1ccc(C(=O)NC2CCNCC2)cc1)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C19H19Cl2N3O2/c20-14-9-13(10-15(21)11-14)19(26)23-16-3-1-12(2-4-16)18(25)24-17-5-7-22-8-6-17/h1-4,9-11,17,22H,5-8H2,(H,23,26)(H,24,25)
InChIKeyUFCQMVZZVINBLS-UHFFFAOYSA-N
XLogP3.73
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.29
LogP ≤ 53.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-acetamido-N-piperidin-4-ylbenzamide;hydrochloride
CID 119385704
4-N-(4-chlorophenyl)-1-N-cyclopentylbenzene-1,4-dicarboxamide
CID 109044491
N-[4-[(4-chlorobenzoyl)amino]phenyl]piperidine-4-carboxamide;hydrochloride
CID 119302107
3,5-dichloro-N-[4-[[4-(cyclopropylcarbamoyl)phenyl]methyl-methylcarbamoyl]phenyl]benzamide
CID 37344285
1-N-cyclopropyl-4-N-(4-fluorophenyl)benzene-1,4-dicarboxamide
CID 109043370
4-chloro-N-[(3R)-pyrrolidin-3-yl]benzamide
CID 79685775
3,5-dichloro-N-(4-chlorophenyl)benzamide
CID 3382216
3,5-dichloro-N-[4-(cyclopropylcarbamoyl)phenyl]-4-methoxybenzamide
CID 51300077
N-piperidin-4-yl-4-sulfanylbenzamide
CID 107023949
3,5-dichloro-N-[4-(2-hydroxyethylcarbamoyl)phenyl]benzamide
CID 78862424
1-(4-chlorophenyl)-3-piperidin-4-ylurea;hydrochloride
CID 53255615
4-N-(4-acetylphenyl)-1-N-cyclopropylbenzene-1,4-dicarboxamide
CID 109043399

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-[4-(piperidin-4-ylcarbamoyl)phenyl]benzamide?
The IUPAC name of 3,5-dichloro-N-[4-(piperidin-4-ylcarbamoyl)phenyl]benzamide (CID 119386610) is 3,5-dichloro-N-[4-(piperidin-4-ylcarbamoyl)phenyl]benzamide.
What is the SMILES notation for 3,5-dichloro-N-[4-(piperidin-4-ylcarbamoyl)phenyl]benzamide?
The canonical SMILES for 3,5-dichloro-N-[4-(piperidin-4-ylcarbamoyl)phenyl]benzamide is O=C(Nc1ccc(C(=O)NC2CCNCC2)cc1)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 3,5-dichloro-N-[4-(piperidin-4-ylcarbamoyl)phenyl]benzamide?
The InChIKey is UFCQMVZZVINBLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19Cl2N3O2/c20-14-9-13(10-15(21)11-14)19(26)23-16-3-1-12(2-4-16)18(25)24-17-5-7-22-8-6-17/h1-4,9-11,17,22H,5-8H2,(H,23,26)(H,24,25).
What are the key properties of 3,5-dichloro-N-[4-(piperidin-4-ylcarbamoyl)phenyl]benzamide?
3,5-dichloro-N-[4-(piperidin-4-ylcarbamoyl)phenyl]benzamide has a molecular weight of 392.29 g/mol, XLogP of 3.73, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-[4-(piperidin-4-ylcarbamoyl)phenyl]benzamide is sourced from PubChem (CID 119386610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).