N-[(3-chlorophenyl)methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide

C24H23ClN2O2 — CID 27535031

IUPACN-[(3-chlorophenyl)methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
SMILESO=C(NCc1cccc(Cl)c1)C1CCN(C(=O)c2cccc3ccccc23)CC1
InChIInChI=1S/C24H23ClN2O2/c25-20-8-3-5-17(15-20)16-26-23(28)19-11-13-27(14-12-19)24(29)22-10-4-7-18-6-1-2-9-21(18)22/h1-10,15,19H,11-14,16H2,(H,26,28)
InChIKeyALTJIYOPXFIKHM-UHFFFAOYSA-N
MW406.91 g/mol
LogP4.66
Rot. Bonds4

About N-[(3-chlorophenyl)methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide

N-[(3-chlorophenyl)methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide (PubChem CID 27535031) has the molecular formula C24H23ClN2O2 and a molecular weight of 406.91 g/mol. Its IUPAC name is N-[(3-chlorophenyl)methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[(3-chlorophenyl)methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
PubChem CID27535031
Molecular FormulaC24H23ClN2O2
Molecular Weight406.91 g/mol
Exact Mass406.14
IUPAC NameN-[(3-chlorophenyl)methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
SMILESO=C(NCc1cccc(Cl)c1)C1CCN(C(=O)c2cccc3ccccc23)CC1
InChIInChI=1S/C24H23ClN2O2/c25-20-8-3-5-17(15-20)16-26-23(28)19-11-13-27(14-12-19)24(29)22-10-4-7-18-6-1-2-9-21(18)22/h1-10,15,19H,11-14,16H2,(H,26,28)
InChIKeyALTJIYOPXFIKHM-UHFFFAOYSA-N
XLogP4.66
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.91
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(4-chlorophenyl)methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 27396099
1-(naphthalene-1-carbonyl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide
CID 17465771
N-[(2-methoxy-4-pyridinyl)methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 18205211
N-(2,4-dichlorophenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 25479669
N-[[4-(methoxymethyl)phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 46415724
N-[[3-(furan-2-carbonylamino)phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 55613801
4-N-[(3-chlorophenyl)methyl]-1-N-phenylpiperidine-1,4-dicarboxamide
CID 7478442
N-[[4-(methylsulfonylmethyl)phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 55898961
N-(3-aminopropyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 119405475
N-benzyl-1-(3-chlorophenyl)piperidine-4-carboxamide
CID 17152955
N-[(4-chlorophenyl)methyl]-1-(2-fluorobenzoyl)piperidine-4-carboxamide
CID 17019078
N-[[4-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 46474002

Frequently Asked Questions

What is the IUPAC name of N-[(3-chlorophenyl)methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide?
The IUPAC name of N-[(3-chlorophenyl)methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide (CID 27535031) is N-[(3-chlorophenyl)methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for N-[(3-chlorophenyl)methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for N-[(3-chlorophenyl)methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide is O=C(NCc1cccc(Cl)c1)C1CCN(C(=O)c2cccc3ccccc23)CC1.
What is the InChIKey of N-[(3-chlorophenyl)methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide?
The InChIKey is ALTJIYOPXFIKHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23ClN2O2/c25-20-8-3-5-17(15-20)16-26-23(28)19-11-13-27(14-12-19)24(29)22-10-4-7-18-6-1-2-9-21(18)22/h1-10,15,19H,11-14,16H2,(H,26,28).
What are the key properties of N-[(3-chlorophenyl)methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide?
N-[(3-chlorophenyl)methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide has a molecular weight of 406.91 g/mol, XLogP of 4.66, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-chlorophenyl)methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 27535031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).