4-N-methyl-1-N-(3-methylphenyl)piperidine-1,4-dicarboxamide

C15H21N3O2 — CID 84531623

IUPAC4-N-methyl-1-N-(3-methylphenyl)piperidine-1,4-dicarboxamide
SMILESCNC(=O)C1CCN(C(=O)Nc2cccc(C)c2)CC1
InChIInChI=1S/C15H21N3O2/c1-11-4-3-5-13(10-11)17-15(20)18-8-6-12(7-9-18)14(19)16-2/h3-5,10,12H,6-9H2,1-2H3,(H,16,19)(H,17,20)
InChIKeyHJIYALUNKSTXJC-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.98
Rot. Bonds2

About 4-N-methyl-1-N-(3-methylphenyl)piperidine-1,4-dicarboxamide

4-N-methyl-1-N-(3-methylphenyl)piperidine-1,4-dicarboxamide (PubChem CID 84531623) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 4-N-methyl-1-N-(3-methylphenyl)piperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name4-N-methyl-1-N-(3-methylphenyl)piperidine-1,4-dicarboxamide
PubChem CID84531623
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name4-N-methyl-1-N-(3-methylphenyl)piperidine-1,4-dicarboxamide
SMILESCNC(=O)C1CCN(C(=O)Nc2cccc(C)c2)CC1
InChIInChI=1S/C15H21N3O2/c1-11-4-3-5-13(10-11)17-15(20)18-8-6-12(7-9-18)14(19)16-2/h3-5,10,12H,6-9H2,1-2H3,(H,16,19)(H,17,20)
InChIKeyHJIYALUNKSTXJC-UHFFFAOYSA-N
XLogP1.98
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-N,4-N-bis(3-methylphenyl)piperidine-1,4-dicarboxamide
CID 3222755
1-[(3-methylphenyl)carbamoyl]piperidine-4-carboxylic acid
CID 16772166
3-N-methyl-1-N-(3-methylphenyl)piperidine-1,3-dicarboxamide
CID 47323838
1-N-(3-methylphenyl)piperidine-1,4-dicarboxamide
CID 16645831
4-(1-aminoethyl)-N-(3-methylphenyl)piperidine-1-carboxamide
CID 63596208
1-N-(3-methylphenyl)-4-N-(2-phenoxyphenyl)piperidine-1,4-dicarboxamide
CID 60541262
4-N-[2-methyl-1-(2-methylphenyl)propyl]-1-N-(3-methylphenyl)piperidine-1,4-dicarboxamide
CID 86939980
4-(methanesulfonamido)-N-(3-methylphenyl)piperidine-1-carboxamide
CID 41430122
1-N-(3-methylphenyl)-4-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]piperidine-1,4-dicarboxamide
CID 86964133
1-N-[4-(aminomethyl)phenyl]-4-N-methylpiperidine-1,4-dicarboxamide
CID 61440098
4-cyclopropylidene-N-(3-methylphenyl)piperidine-1-carboxamide
CID 121187164
tert-butyl 4-[(3-methylphenyl)carbamoyl]piperidine-1-carboxylate
CID 9039069

Frequently Asked Questions

What is the IUPAC name of 4-N-methyl-1-N-(3-methylphenyl)piperidine-1,4-dicarboxamide?
The IUPAC name of 4-N-methyl-1-N-(3-methylphenyl)piperidine-1,4-dicarboxamide (CID 84531623) is 4-N-methyl-1-N-(3-methylphenyl)piperidine-1,4-dicarboxamide.
What is the SMILES notation for 4-N-methyl-1-N-(3-methylphenyl)piperidine-1,4-dicarboxamide?
The canonical SMILES for 4-N-methyl-1-N-(3-methylphenyl)piperidine-1,4-dicarboxamide is CNC(=O)C1CCN(C(=O)Nc2cccc(C)c2)CC1.
What is the InChIKey of 4-N-methyl-1-N-(3-methylphenyl)piperidine-1,4-dicarboxamide?
The InChIKey is HJIYALUNKSTXJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-11-4-3-5-13(10-11)17-15(20)18-8-6-12(7-9-18)14(19)16-2/h3-5,10,12H,6-9H2,1-2H3,(H,16,19)(H,17,20).
What are the key properties of 4-N-methyl-1-N-(3-methylphenyl)piperidine-1,4-dicarboxamide?
4-N-methyl-1-N-(3-methylphenyl)piperidine-1,4-dicarboxamide has a molecular weight of 275.35 g/mol, XLogP of 1.98, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-methyl-1-N-(3-methylphenyl)piperidine-1,4-dicarboxamide is sourced from PubChem (CID 84531623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).