N-(cyclohex-3-en-1-ylmethyl)-3,5-dimethylpiperidine-1-carboxamide

C15H26N2O — CID 60593450

IUPACN-(cyclohex-3-en-1-ylmethyl)-3,5-dimethylpiperidine-1-carboxamide
SMILESCC1CC(C)CN(C(=O)NCC2CC=CCC2)C1
InChIInChI=1S/C15H26N2O/c1-12-8-13(2)11-17(10-12)15(18)16-9-14-6-4-3-5-7-14/h3-4,12-14H,5-11H2,1-2H3,(H,16,18)
InChIKeyNWLZBLSOUGGFHT-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.03
Rot. Bonds2

About N-(cyclohex-3-en-1-ylmethyl)-3,5-dimethylpiperidine-1-carboxamide

N-(cyclohex-3-en-1-ylmethyl)-3,5-dimethylpiperidine-1-carboxamide (PubChem CID 60593450) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is N-(cyclohex-3-en-1-ylmethyl)-3,5-dimethylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-(cyclohex-3-en-1-ylmethyl)-3,5-dimethylpiperidine-1-carboxamide
PubChem CID60593450
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC NameN-(cyclohex-3-en-1-ylmethyl)-3,5-dimethylpiperidine-1-carboxamide
SMILESCC1CC(C)CN(C(=O)NCC2CC=CCC2)C1
InChIInChI=1S/C15H26N2O/c1-12-8-13(2)11-17(10-12)15(18)16-9-14-6-4-3-5-7-14/h3-4,12-14H,5-11H2,1-2H3,(H,16,18)
InChIKeyNWLZBLSOUGGFHT-UHFFFAOYSA-N
XLogP3.03
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-(cyclohex-3-en-1-ylmethylcarbamoyl)-4-methylpiperidine-2-carboxylic acid
CID 114425494
methyl (3R)-1-[[(1R)-cyclohex-3-en-1-yl]methylcarbamoyl]piperidine-3-carboxylate
CID 124593338
N-(cyclohex-3-en-1-ylmethyl)-1,4-thiazepane-4-carboxamide
CID 128950604
4-[[(3,5-dimethylpiperidine-1-carbonyl)amino]methyl]cyclohexane-1-carboxylic acid
CID 79525376
methyl 1-(cyclohex-3-en-1-ylmethylcarbamoyl)-3-fluoropyrrolidine-3-carboxylate
CID 71866434
N-(cyclohex-3-en-1-ylmethyl)-4-(5-methyl-1,3,4-oxadiazol-2-yl)piperidine-1-carboxamide
CID 146149857
1-(cyclohex-3-en-1-ylmethylcarbamoyl)-4-ethylpiperidine-2-carboxylic acid
CID 114430337
N-(cyclohex-3-en-1-ylmethyl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxamide
CID 49128178
5-methyl-1-[(4-methylcyclohexyl)methylcarbamoyl]piperidine-3-carboxylic acid
CID 122122424
N-(cyclohex-3-en-1-ylmethyl)-4-[(3-methylphenyl)methyl]piperazine-1-carboxamide
CID 60593302
methyl 2-(cyclohex-3-en-1-ylmethylamino)-2-oxoacetate
CID 112617086
1-[3-(cyclohex-3-en-1-ylmethylamino)pyrrolidin-1-yl]ethanone
CID 115757149

Frequently Asked Questions

What is the IUPAC name of N-(cyclohex-3-en-1-ylmethyl)-3,5-dimethylpiperidine-1-carboxamide?
The IUPAC name of N-(cyclohex-3-en-1-ylmethyl)-3,5-dimethylpiperidine-1-carboxamide (CID 60593450) is N-(cyclohex-3-en-1-ylmethyl)-3,5-dimethylpiperidine-1-carboxamide.
What is the SMILES notation for N-(cyclohex-3-en-1-ylmethyl)-3,5-dimethylpiperidine-1-carboxamide?
The canonical SMILES for N-(cyclohex-3-en-1-ylmethyl)-3,5-dimethylpiperidine-1-carboxamide is CC1CC(C)CN(C(=O)NCC2CC=CCC2)C1.
What is the InChIKey of N-(cyclohex-3-en-1-ylmethyl)-3,5-dimethylpiperidine-1-carboxamide?
The InChIKey is NWLZBLSOUGGFHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-12-8-13(2)11-17(10-12)15(18)16-9-14-6-4-3-5-7-14/h3-4,12-14H,5-11H2,1-2H3,(H,16,18).
What are the key properties of N-(cyclohex-3-en-1-ylmethyl)-3,5-dimethylpiperidine-1-carboxamide?
N-(cyclohex-3-en-1-ylmethyl)-3,5-dimethylpiperidine-1-carboxamide has a molecular weight of 250.39 g/mol, XLogP of 3.03, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohex-3-en-1-ylmethyl)-3,5-dimethylpiperidine-1-carboxamide is sourced from PubChem (CID 60593450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).