N-[(3,5-dichlorophenyl)methyl]-N,4-dimethylpiperidine-4-carboxamide

C15H20Cl2N2O — CID 63121984

IUPACN-[(3,5-dichlorophenyl)methyl]-N,4-dimethylpiperidine-4-carboxamide
SMILESCN(Cc1cc(Cl)cc(Cl)c1)C(=O)C1(C)CCNCC1
InChIInChI=1S/C15H20Cl2N2O/c1-15(3-5-18-6-4-15)14(20)19(2)10-11-7-12(16)9-13(17)8-11/h7-9,18H,3-6,10H2,1-2H3
InChIKeyHYKZNCPVBVNQKP-UHFFFAOYSA-N
MW315.24 g/mol
LogP3.34
Rot. Bonds3

About N-[(3,5-dichlorophenyl)methyl]-N,4-dimethylpiperidine-4-carboxamide

N-[(3,5-dichlorophenyl)methyl]-N,4-dimethylpiperidine-4-carboxamide (PubChem CID 63121984) has the molecular formula C15H20Cl2N2O and a molecular weight of 315.24 g/mol. Its IUPAC name is N-[(3,5-dichlorophenyl)methyl]-N,4-dimethylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-[(3,5-dichlorophenyl)methyl]-N,4-dimethylpiperidine-4-carboxamide
PubChem CID63121984
Molecular FormulaC15H20Cl2N2O
Molecular Weight315.24 g/mol
Exact Mass314.10
IUPAC NameN-[(3,5-dichlorophenyl)methyl]-N,4-dimethylpiperidine-4-carboxamide
SMILESCN(Cc1cc(Cl)cc(Cl)c1)C(=O)C1(C)CCNCC1
InChIInChI=1S/C15H20Cl2N2O/c1-15(3-5-18-6-4-15)14(20)19(2)10-11-7-12(16)9-13(17)8-11/h7-9,18H,3-6,10H2,1-2H3
InChIKeyHYKZNCPVBVNQKP-UHFFFAOYSA-N
XLogP3.34
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.24
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(3,5-dichlorophenyl)methyl]-N,4-dimethylpiperidine-4-carboxamide?
The IUPAC name of N-[(3,5-dichlorophenyl)methyl]-N,4-dimethylpiperidine-4-carboxamide (CID 63121984) is N-[(3,5-dichlorophenyl)methyl]-N,4-dimethylpiperidine-4-carboxamide.
What is the SMILES notation for N-[(3,5-dichlorophenyl)methyl]-N,4-dimethylpiperidine-4-carboxamide?
The canonical SMILES for N-[(3,5-dichlorophenyl)methyl]-N,4-dimethylpiperidine-4-carboxamide is CN(Cc1cc(Cl)cc(Cl)c1)C(=O)C1(C)CCNCC1.
What is the InChIKey of N-[(3,5-dichlorophenyl)methyl]-N,4-dimethylpiperidine-4-carboxamide?
The InChIKey is HYKZNCPVBVNQKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20Cl2N2O/c1-15(3-5-18-6-4-15)14(20)19(2)10-11-7-12(16)9-13(17)8-11/h7-9,18H,3-6,10H2,1-2H3.
What are the key properties of N-[(3,5-dichlorophenyl)methyl]-N,4-dimethylpiperidine-4-carboxamide?
N-[(3,5-dichlorophenyl)methyl]-N,4-dimethylpiperidine-4-carboxamide has a molecular weight of 315.24 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,5-dichlorophenyl)methyl]-N,4-dimethylpiperidine-4-carboxamide is sourced from PubChem (CID 63121984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).