(3R)-3-N-[2-(2,3-dichlorophenyl)ethyl]piperidine-1,3-dicarboxamide

C15H19Cl2N3O2 — CID 95156511

IUPAC(3R)-3-N-[2-(2,3-dichlorophenyl)ethyl]piperidine-1,3-dicarboxamide
SMILESNC(=O)N1CCC[C@@H](C(=O)NCCc2cccc(Cl)c2Cl)C1
InChIInChI=1S/C15H19Cl2N3O2/c16-12-5-1-3-10(13(12)17)6-7-19-14(21)11-4-2-8-20(9-11)15(18)22/h1,3,5,11H,2,4,6-9H2,(H2,18,22)(H,19,21)/t11-/m1/s1
InChIKeyMVKRKFVCKQFEEX-LLVKDONJSA-N
MW344.24 g/mol
LogP2.44
Rot. Bonds4

About (3R)-3-N-[2-(2,3-dichlorophenyl)ethyl]piperidine-1,3-dicarboxamide

(3R)-3-N-[2-(2,3-dichlorophenyl)ethyl]piperidine-1,3-dicarboxamide (PubChem CID 95156511) has the molecular formula C15H19Cl2N3O2 and a molecular weight of 344.24 g/mol. Its IUPAC name is (3R)-3-N-[2-(2,3-dichlorophenyl)ethyl]piperidine-1,3-dicarboxamide.

Molecular Properties

Compound Name(3R)-3-N-[2-(2,3-dichlorophenyl)ethyl]piperidine-1,3-dicarboxamide
PubChem CID95156511
Molecular FormulaC15H19Cl2N3O2
Molecular Weight344.24 g/mol
Exact Mass343.09
IUPAC Name(3R)-3-N-[2-(2,3-dichlorophenyl)ethyl]piperidine-1,3-dicarboxamide
SMILESNC(=O)N1CCC[C@@H](C(=O)NCCc2cccc(Cl)c2Cl)C1
InChIInChI=1S/C15H19Cl2N3O2/c16-12-5-1-3-10(13(12)17)6-7-19-14(21)11-4-2-8-20(9-11)15(18)22/h1,3,5,11H,2,4,6-9H2,(H2,18,22)(H,19,21)/t11-/m1/s1
InChIKeyMVKRKFVCKQFEEX-LLVKDONJSA-N
XLogP2.44
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.24
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-3-N-[2-(4-chlorophenyl)ethyl]piperidine-1,3-dicarboxamide
CID 9081950
(3R)-3-N-[2-(4-chlorophenyl)ethyl]piperidine-1,3-dicarboxamide
CID 9081948
(3S)-3-N-[2-(3,5-dichlorophenyl)ethyl]piperidine-1,3-dicarboxamide
CID 95160101
3-N-[3-[(2-chlorophenyl)methylsulfanyl]propyl]piperidine-1,3-dicarboxamide
CID 70769016
4-[2-(2,3-dichlorophenyl)ethylcarbamoyl]cyclohexane-1-carboxylic acid
CID 120672916
(3S)-3-N-[2-(3-chloro-2-methylanilino)-2-oxoethyl]piperidine-1,3-dicarboxamide
CID 51924999
3-amino-N-[2-(2,3-dichlorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride
CID 119736254
3-N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]piperidine-1,3-dicarboxamide
CID 70742198
(3S)-3-N-benzylpiperidine-1,3-dicarboxamide
CID 9070998
(3R)-3-N-[(2-chloro-4-fluorophenyl)methyl]piperidine-1,3-dicarboxamide
CID 97116009
(3R)-3-[[(2-chlorobenzoyl)amino]carbamoyl]piperidine-1-carboxamide
CID 8870376
(3S)-3-amino-N-[(2,3-dichlorophenyl)methyl]piperidine-1-carboxamide
CID 131895525

Frequently Asked Questions

What is the IUPAC name of (3R)-3-N-[2-(2,3-dichlorophenyl)ethyl]piperidine-1,3-dicarboxamide?
The IUPAC name of (3R)-3-N-[2-(2,3-dichlorophenyl)ethyl]piperidine-1,3-dicarboxamide (CID 95156511) is (3R)-3-N-[2-(2,3-dichlorophenyl)ethyl]piperidine-1,3-dicarboxamide.
What is the SMILES notation for (3R)-3-N-[2-(2,3-dichlorophenyl)ethyl]piperidine-1,3-dicarboxamide?
The canonical SMILES for (3R)-3-N-[2-(2,3-dichlorophenyl)ethyl]piperidine-1,3-dicarboxamide is NC(=O)N1CCC[C@@H](C(=O)NCCc2cccc(Cl)c2Cl)C1.
What is the InChIKey of (3R)-3-N-[2-(2,3-dichlorophenyl)ethyl]piperidine-1,3-dicarboxamide?
The InChIKey is MVKRKFVCKQFEEX-LLVKDONJSA-N. The full InChI is InChI=1S/C15H19Cl2N3O2/c16-12-5-1-3-10(13(12)17)6-7-19-14(21)11-4-2-8-20(9-11)15(18)22/h1,3,5,11H,2,4,6-9H2,(H2,18,22)(H,19,21)/t11-/m1/s1.
What are the key properties of (3R)-3-N-[2-(2,3-dichlorophenyl)ethyl]piperidine-1,3-dicarboxamide?
(3R)-3-N-[2-(2,3-dichlorophenyl)ethyl]piperidine-1,3-dicarboxamide has a molecular weight of 344.24 g/mol, XLogP of 2.44, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-N-[2-(2,3-dichlorophenyl)ethyl]piperidine-1,3-dicarboxamide is sourced from PubChem (CID 95156511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).