N-cyclohexyl-1-[(2,4-dichlorophenyl)methyl]piperidine-4-carboxamide

C19H26Cl2N2O — CID 53284580

IUPACN-cyclohexyl-1-[(2,4-dichlorophenyl)methyl]piperidine-4-carboxamide
SMILESO=C(NC1CCCCC1)C1CCN(Cc2ccc(Cl)cc2Cl)CC1
InChIInChI=1S/C19H26Cl2N2O/c20-16-7-6-15(18(21)12-16)13-23-10-8-14(9-11-23)19(24)22-17-4-2-1-3-5-17/h6-7,12,14,17H,1-5,8-11,13H2,(H,22,24)
InChIKeyKGHVWQOXFXITJS-UHFFFAOYSA-N
MW369.34 g/mol
LogP4.65
Rot. Bonds4

About N-cyclohexyl-1-[(2,4-dichlorophenyl)methyl]piperidine-4-carboxamide

N-cyclohexyl-1-[(2,4-dichlorophenyl)methyl]piperidine-4-carboxamide (PubChem CID 53284580) has the molecular formula C19H26Cl2N2O and a molecular weight of 369.34 g/mol. Its IUPAC name is N-cyclohexyl-1-[(2,4-dichlorophenyl)methyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-1-[(2,4-dichlorophenyl)methyl]piperidine-4-carboxamide
PubChem CID53284580
Molecular FormulaC19H26Cl2N2O
Molecular Weight369.34 g/mol
Exact Mass368.14
IUPAC NameN-cyclohexyl-1-[(2,4-dichlorophenyl)methyl]piperidine-4-carboxamide
SMILESO=C(NC1CCCCC1)C1CCN(Cc2ccc(Cl)cc2Cl)CC1
InChIInChI=1S/C19H26Cl2N2O/c20-16-7-6-15(18(21)12-16)13-23-10-8-14(9-11-23)19(24)22-17-4-2-1-3-5-17/h6-7,12,14,17H,1-5,8-11,13H2,(H,22,24)
InChIKeyKGHVWQOXFXITJS-UHFFFAOYSA-N
XLogP4.65
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.34
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Diclocymet
CID 11527333
Uamc00039
CID 11232124
1-Benzyl-N-{3-[4-(2,6-Dichlorophenyl)piperidin-1-Yl]propyl}-D-Prolinamide
CID 25001412
N-(1-benzyl-4-piperidinyl)-2,4-dichlorobenzamide
CID 1069892
2,6-Dichloro-N-[1-(1-methylethyl)-4-piperidinyl]benzamide
CID 25236799
2-(S)-Amino-4-(2-chloro-benzylamino)-1-piperidin-1-yl-butan-1-one
CID 11232123
3-chloro-N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-1,3-dimethylcyclobutane-1-carboxamide
CID 23550315
4-((4-Chlorophenyl)(2,4-dichlorophenyl)methyl)-N-cyclohexylpiperazine-1-carboxamide
CID 44176908
N-[2-(1-benzylpiperidin-4-yl)ethyl]-4-chlorobenzamide hydrochloride
CID 14783875
(S)-2-Amino-4-[(4-chloro-benzyl)-methyl-amino]-1-piperidin-1-yl-butan-1-one
CID 10019118
(S)-2-Amino-4-(4-chloro-benzylamino)-1-(4-methyl-piperidin-1-yl)-butan-1-one
CID 10403949
(S)-2-Amino-4-(4-chloro-benzylamino)-1-(4-fluoro-piperidin-1-yl)-butan-1-one
CID 11450265

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1-[(2,4-dichlorophenyl)methyl]piperidine-4-carboxamide?
The IUPAC name of N-cyclohexyl-1-[(2,4-dichlorophenyl)methyl]piperidine-4-carboxamide (CID 53284580) is N-cyclohexyl-1-[(2,4-dichlorophenyl)methyl]piperidine-4-carboxamide.
What is the SMILES notation for N-cyclohexyl-1-[(2,4-dichlorophenyl)methyl]piperidine-4-carboxamide?
The canonical SMILES for N-cyclohexyl-1-[(2,4-dichlorophenyl)methyl]piperidine-4-carboxamide is O=C(NC1CCCCC1)C1CCN(Cc2ccc(Cl)cc2Cl)CC1.
What is the InChIKey of N-cyclohexyl-1-[(2,4-dichlorophenyl)methyl]piperidine-4-carboxamide?
The InChIKey is KGHVWQOXFXITJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26Cl2N2O/c20-16-7-6-15(18(21)12-16)13-23-10-8-14(9-11-23)19(24)22-17-4-2-1-3-5-17/h6-7,12,14,17H,1-5,8-11,13H2,(H,22,24).
What are the key properties of N-cyclohexyl-1-[(2,4-dichlorophenyl)methyl]piperidine-4-carboxamide?
N-cyclohexyl-1-[(2,4-dichlorophenyl)methyl]piperidine-4-carboxamide has a molecular weight of 369.34 g/mol, XLogP of 4.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1-[(2,4-dichlorophenyl)methyl]piperidine-4-carboxamide is sourced from PubChem (CID 53284580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).