N-(2,6-dimethylphenyl)piperidine-3-carboxamide

C14H20N2O — CID 652497

IUPACN-(2,6-dimethylphenyl)piperidine-3-carboxamide
SMILESCc1cccc(C)c1NC(=O)C1CCCNC1
InChIInChI=1S/C14H20N2O/c1-10-5-3-6-11(2)13(10)16-14(17)12-7-4-8-15-9-12/h3,5-6,12,15H,4,7-9H2,1-2H3,(H,16,17)
InChIKeyDZYUAAHPVDFFEQ-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.24
Rot. Bonds2

About N-(2,6-dimethylphenyl)piperidine-3-carboxamide

N-(2,6-dimethylphenyl)piperidine-3-carboxamide (PubChem CID 652497) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)piperidine-3-carboxamide
PubChem CID652497
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC NameN-(2,6-dimethylphenyl)piperidine-3-carboxamide
SMILESCc1cccc(C)c1NC(=O)C1CCCNC1
InChIInChI=1S/C14H20N2O/c1-10-5-3-6-11(2)13(10)16-14(17)12-7-4-8-15-9-12/h3,5-6,12,15H,4,7-9H2,1-2H3,(H,16,17)
InChIKeyDZYUAAHPVDFFEQ-UHFFFAOYSA-N
XLogP2.24
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)piperidine-3-carboxamide?
The IUPAC name of N-(2,6-dimethylphenyl)piperidine-3-carboxamide (CID 652497) is N-(2,6-dimethylphenyl)piperidine-3-carboxamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)piperidine-3-carboxamide?
The canonical SMILES for N-(2,6-dimethylphenyl)piperidine-3-carboxamide is Cc1cccc(C)c1NC(=O)C1CCCNC1.
What is the InChIKey of N-(2,6-dimethylphenyl)piperidine-3-carboxamide?
The InChIKey is DZYUAAHPVDFFEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-10-5-3-6-11(2)13(10)16-14(17)12-7-4-8-15-9-12/h3,5-6,12,15H,4,7-9H2,1-2H3,(H,16,17).
What are the key properties of N-(2,6-dimethylphenyl)piperidine-3-carboxamide?
N-(2,6-dimethylphenyl)piperidine-3-carboxamide has a molecular weight of 232.33 g/mol, XLogP of 2.24, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)piperidine-3-carboxamide is sourced from PubChem (CID 652497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).