N-(2,6-dichloro-3-methylphenyl)-4-ethylpiperidine-2-carboxamide

C15H20Cl2N2O — CID 114427824

IUPACN-(2,6-dichloro-3-methylphenyl)-4-ethylpiperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)Nc2c(Cl)ccc(C)c2Cl)C1
InChIInChI=1S/C15H20Cl2N2O/c1-3-10-6-7-18-12(8-10)15(20)19-14-11(16)5-4-9(2)13(14)17/h4-5,10,12,18H,3,6-8H2,1-2H3,(H,19,20)
InChIKeyPVNNOAMFLQLBAU-UHFFFAOYSA-N
MW315.24 g/mol
LogP4.02
Rot. Bonds3

About N-(2,6-dichloro-3-methylphenyl)-4-ethylpiperidine-2-carboxamide

N-(2,6-dichloro-3-methylphenyl)-4-ethylpiperidine-2-carboxamide (PubChem CID 114427824) has the molecular formula C15H20Cl2N2O and a molecular weight of 315.24 g/mol. Its IUPAC name is N-(2,6-dichloro-3-methylphenyl)-4-ethylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-(2,6-dichloro-3-methylphenyl)-4-ethylpiperidine-2-carboxamide
PubChem CID114427824
Molecular FormulaC15H20Cl2N2O
Molecular Weight315.24 g/mol
Exact Mass314.10
IUPAC NameN-(2,6-dichloro-3-methylphenyl)-4-ethylpiperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)Nc2c(Cl)ccc(C)c2Cl)C1
InChIInChI=1S/C15H20Cl2N2O/c1-3-10-6-7-18-12(8-10)15(20)19-14-11(16)5-4-9(2)13(14)17/h4-5,10,12,18H,3,6-8H2,1-2H3,(H,19,20)
InChIKeyPVNNOAMFLQLBAU-UHFFFAOYSA-N
XLogP4.02
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.24
LogP ≤ 54.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-chloro-6-methylphenyl)-4-ethylpiperidine-2-carboxamide
CID 114429222
4-ethyl-N-(2,4,6-trichlorophenyl)piperidine-2-carboxamide
CID 114428009
N-(2,6-difluorophenyl)-4-ethylpiperidine-2-carboxamide
CID 114428002
N-(2,6-dichloro-3-methylphenyl)-2-methylpiperidine-4-carboxamide
CID 106738532
N-(2-chloro-5-methoxyphenyl)-4-ethylpiperidine-2-carboxamide
CID 114428835
N-(2,3-dimethylphenyl)-4-ethylpiperidine-2-carboxamide
CID 114427932
5-[(4-ethylpiperidine-2-carbonyl)amino]-2-methylbenzoic acid
CID 114429036
N-(5-cyano-2-methylphenyl)-4-ethylpiperidine-2-carboxamide
CID 114428897
4-ethyl-N-(4-fluoro-3-methylphenyl)piperidine-2-carboxamide
CID 114428947
N-[3-chloro-4-(dimethylamino)phenyl]-4-ethylpiperidine-2-carboxamide
CID 114428363
N-(4-carbamoyl-3-chlorophenyl)-4-ethylpiperidine-2-carboxamide
CID 114428317
N-(2-bromo-5-chlorophenyl)-4-ethylpiperidine-2-carboxamide
CID 114429344

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichloro-3-methylphenyl)-4-ethylpiperidine-2-carboxamide?
The IUPAC name of N-(2,6-dichloro-3-methylphenyl)-4-ethylpiperidine-2-carboxamide (CID 114427824) is N-(2,6-dichloro-3-methylphenyl)-4-ethylpiperidine-2-carboxamide.
What is the SMILES notation for N-(2,6-dichloro-3-methylphenyl)-4-ethylpiperidine-2-carboxamide?
The canonical SMILES for N-(2,6-dichloro-3-methylphenyl)-4-ethylpiperidine-2-carboxamide is CCC1CCNC(C(=O)Nc2c(Cl)ccc(C)c2Cl)C1.
What is the InChIKey of N-(2,6-dichloro-3-methylphenyl)-4-ethylpiperidine-2-carboxamide?
The InChIKey is PVNNOAMFLQLBAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20Cl2N2O/c1-3-10-6-7-18-12(8-10)15(20)19-14-11(16)5-4-9(2)13(14)17/h4-5,10,12,18H,3,6-8H2,1-2H3,(H,19,20).
What are the key properties of N-(2,6-dichloro-3-methylphenyl)-4-ethylpiperidine-2-carboxamide?
N-(2,6-dichloro-3-methylphenyl)-4-ethylpiperidine-2-carboxamide has a molecular weight of 315.24 g/mol, XLogP of 4.02, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichloro-3-methylphenyl)-4-ethylpiperidine-2-carboxamide is sourced from PubChem (CID 114427824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).