6-methyl-N-[3-[methyl(propan-2-yl)amino]propyl]piperidine-2-carboxamide

C14H29N3O — CID 114140614

IUPAC6-methyl-N-[3-[methyl(propan-2-yl)amino]propyl]piperidine-2-carboxamide
SMILESCC1CCCC(C(=O)NCCCN(C)C(C)C)N1
InChIInChI=1S/C14H29N3O/c1-11(2)17(4)10-6-9-15-14(18)13-8-5-7-12(3)16-13/h11-13,16H,5-10H2,1-4H3,(H,15,18)
InChIKeyOWKKYOCGEBOWKK-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.36
Rot. Bonds6

About 6-methyl-N-[3-[methyl(propan-2-yl)amino]propyl]piperidine-2-carboxamide

6-methyl-N-[3-[methyl(propan-2-yl)amino]propyl]piperidine-2-carboxamide (PubChem CID 114140614) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 6-methyl-N-[3-[methyl(propan-2-yl)amino]propyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name6-methyl-N-[3-[methyl(propan-2-yl)amino]propyl]piperidine-2-carboxamide
PubChem CID114140614
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name6-methyl-N-[3-[methyl(propan-2-yl)amino]propyl]piperidine-2-carboxamide
SMILESCC1CCCC(C(=O)NCCCN(C)C(C)C)N1
InChIInChI=1S/C14H29N3O/c1-11(2)17(4)10-6-9-15-14(18)13-8-5-7-12(3)16-13/h11-13,16H,5-10H2,1-4H3,(H,15,18)
InChIKeyOWKKYOCGEBOWKK-UHFFFAOYSA-N
XLogP1.36
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-methyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide
CID 62641371
6-methyl-N-(2-methylpropyl)piperidine-2-carboxamide
CID 24690890
6-methyl-N-(2-methylbutyl)piperidine-2-carboxamide
CID 62694589
(2S)-N-[2-[methyl(propan-2-yl)amino]ethyl]pyrrolidine-2-carboxamide
CID 62639882
4-methyl-N-[4-[methyl(propan-2-yl)amino]butyl]piperidine-2-carboxamide
CID 114423872
N-(2-cyclopentylethyl)-6-methylpiperidine-2-carboxamide
CID 54932990
6-methyl-N-[2-(methylsulfamoyl)ethyl]piperidine-2-carboxamide
CID 114175577
N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide
CID 62641689
6-methyl-N-[3-(2-methylpiperidin-1-yl)propyl]piperidine-2-carboxamide
CID 24710095
2-(aminomethyl)-N-[3-[methyl(propan-2-yl)amino]propyl]cyclohexane-1-carboxamide
CID 106047668
6-methyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide
CID 24704463
N-[3-[methyl(propan-2-yl)amino]propyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
CID 106047759

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[3-[methyl(propan-2-yl)amino]propyl]piperidine-2-carboxamide?
The IUPAC name of 6-methyl-N-[3-[methyl(propan-2-yl)amino]propyl]piperidine-2-carboxamide (CID 114140614) is 6-methyl-N-[3-[methyl(propan-2-yl)amino]propyl]piperidine-2-carboxamide.
What is the SMILES notation for 6-methyl-N-[3-[methyl(propan-2-yl)amino]propyl]piperidine-2-carboxamide?
The canonical SMILES for 6-methyl-N-[3-[methyl(propan-2-yl)amino]propyl]piperidine-2-carboxamide is CC1CCCC(C(=O)NCCCN(C)C(C)C)N1.
What is the InChIKey of 6-methyl-N-[3-[methyl(propan-2-yl)amino]propyl]piperidine-2-carboxamide?
The InChIKey is OWKKYOCGEBOWKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-11(2)17(4)10-6-9-15-14(18)13-8-5-7-12(3)16-13/h11-13,16H,5-10H2,1-4H3,(H,15,18).
What are the key properties of 6-methyl-N-[3-[methyl(propan-2-yl)amino]propyl]piperidine-2-carboxamide?
6-methyl-N-[3-[methyl(propan-2-yl)amino]propyl]piperidine-2-carboxamide has a molecular weight of 255.41 g/mol, XLogP of 1.36, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[3-[methyl(propan-2-yl)amino]propyl]piperidine-2-carboxamide is sourced from PubChem (CID 114140614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).