N-(2,4-dichlorophenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide

C23H20Cl2N2O2 — CID 25479669

IUPACN-(2,4-dichlorophenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1Cl)C1CCN(C(=O)c2cccc3ccccc23)CC1
InChIInChI=1S/C23H20Cl2N2O2/c24-17-8-9-21(20(25)14-17)26-22(28)16-10-12-27(13-11-16)23(29)19-7-3-5-15-4-1-2-6-18(15)19/h1-9,14,16H,10-13H2,(H,26,28)
InChIKeyAZNBPSAIJZYWLW-UHFFFAOYSA-N
MW427.33 g/mol
LogP5.64
Rot. Bonds3

About N-(2,4-dichlorophenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide

N-(2,4-dichlorophenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide (PubChem CID 25479669) has the molecular formula C23H20Cl2N2O2 and a molecular weight of 427.33 g/mol. Its IUPAC name is N-(2,4-dichlorophenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2,4-dichlorophenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
PubChem CID25479669
Molecular FormulaC23H20Cl2N2O2
Molecular Weight427.33 g/mol
Exact Mass426.09
IUPAC NameN-(2,4-dichlorophenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1Cl)C1CCN(C(=O)c2cccc3ccccc23)CC1
InChIInChI=1S/C23H20Cl2N2O2/c24-17-8-9-21(20(25)14-17)26-22(28)16-10-12-27(13-11-16)23(29)19-7-3-5-15-4-1-2-6-18(15)19/h1-9,14,16H,10-13H2,(H,26,28)
InChIKeyAZNBPSAIJZYWLW-UHFFFAOYSA-N
XLogP5.64
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500427.33
LogP ≤ 55.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-fluorophenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 27396109
N-[(1S)-1-(2,4-dichlorophenyl)ethyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 27418677
N-[(3-chlorophenyl)methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 27535031
N-[2-chloro-5-(propanoylamino)phenyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 55798979
N-[(4-chlorophenyl)methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 27396099
N-(4-fluoro-2-methylphenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 25492477
N-(5-amino-2-methylphenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide;hydrochloride
CID 120568777
methyl 2-[[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]amino]benzoate
CID 55430267
N-(2-fluoro-5-methylsulfonylphenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 55429991
N-(3-chloro-4-piperidin-1-ylphenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 55884883
N-[4-(dimethylamino)-2-methylphenyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 55780129
1-(2-chlorobenzoyl)-N-(2-chloro-4-nitrophenyl)piperidine-4-carboxamide
CID 17223292

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dichlorophenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide?
The IUPAC name of N-(2,4-dichlorophenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide (CID 25479669) is N-(2,4-dichlorophenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(2,4-dichlorophenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for N-(2,4-dichlorophenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide is O=C(Nc1ccc(Cl)cc1Cl)C1CCN(C(=O)c2cccc3ccccc23)CC1.
What is the InChIKey of N-(2,4-dichlorophenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide?
The InChIKey is AZNBPSAIJZYWLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20Cl2N2O2/c24-17-8-9-21(20(25)14-17)26-22(28)16-10-12-27(13-11-16)23(29)19-7-3-5-15-4-1-2-6-18(15)19/h1-9,14,16H,10-13H2,(H,26,28).
What are the key properties of N-(2,4-dichlorophenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide?
N-(2,4-dichlorophenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide has a molecular weight of 427.33 g/mol, XLogP of 5.64, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dichlorophenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 25479669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).