N-[2-(cyclohexen-1-yl)-2-methylpropyl]-2-(1-methoxypiperidin-4-yl)acetamide

C18H32N2O2 — CID 167816633

IUPACN-[2-(cyclohexen-1-yl)-2-methylpropyl]-2-(1-methoxypiperidin-4-yl)acetamide
SMILESCON1CCC(CC(=O)NCC(C)(C)C2=CCCCC2)CC1
InChIInChI=1S/C18H32N2O2/c1-18(2,16-7-5-4-6-8-16)14-19-17(21)13-15-9-11-20(22-3)12-10-15/h7,15H,4-6,8-14H2,1-3H3,(H,19,21)
InChIKeySCJWQYLHTZMBLQ-UHFFFAOYSA-N
MW308.47 g/mol
LogP3.29
Rot. Bonds6

About N-[2-(cyclohexen-1-yl)-2-methylpropyl]-2-(1-methoxypiperidin-4-yl)acetamide

N-[2-(cyclohexen-1-yl)-2-methylpropyl]-2-(1-methoxypiperidin-4-yl)acetamide (PubChem CID 167816633) has the molecular formula C18H32N2O2 and a molecular weight of 308.47 g/mol. Its IUPAC name is N-[2-(cyclohexen-1-yl)-2-methylpropyl]-2-(1-methoxypiperidin-4-yl)acetamide.

Molecular Properties

Compound NameN-[2-(cyclohexen-1-yl)-2-methylpropyl]-2-(1-methoxypiperidin-4-yl)acetamide
PubChem CID167816633
Molecular FormulaC18H32N2O2
Molecular Weight308.47 g/mol
Exact Mass308.25
IUPAC NameN-[2-(cyclohexen-1-yl)-2-methylpropyl]-2-(1-methoxypiperidin-4-yl)acetamide
SMILESCON1CCC(CC(=O)NCC(C)(C)C2=CCCCC2)CC1
InChIInChI=1S/C18H32N2O2/c1-18(2,16-7-5-4-6-8-16)14-19-17(21)13-15-9-11-20(22-3)12-10-15/h7,15H,4-6,8-14H2,1-3H3,(H,19,21)
InChIKeySCJWQYLHTZMBLQ-UHFFFAOYSA-N
XLogP3.29
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.47
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-[[2-(cyclohexen-1-yl)-2-methylpropyl]carbamoylamino]butanoic acid
CID 122010471
N-[1-(methanesulfonamido)-2-methylpropan-2-yl]-2-(1-methoxypiperidin-4-yl)acetamide
CID 155954625
1-[2-(cyclopenten-1-yl)-2-methylpropyl]-3-(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)urea
CID 128633885
N-[2-(cyclohexen-1-yl)-2-methylpropyl]-3-(hydroxymethyl)-3,4-dimethylpyrrolidine-1-carboxamide
CID 136553126
N-[2-(1,4-dimethylpyrazol-3-yl)ethyl]-2-(1-methoxypiperidin-4-yl)acetamide
CID 155960489
2-(cyclohexen-1-yl)propan-2-yl 2,2-dimethylbutanoate
CID 163511434
N-[2-(cyclohexen-1-yl)ethyl]-2-cyclohexylacetamide
CID 848109
2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-[2-(cyclohexen-1-yl)ethyl]acetamide
CID 46295211
methyl 2-[(2-cyclohexylacetyl)amino]acetate
CID 43404765
(3aS,6aR)-2-[[2-(cyclopenten-1-yl)-2-methylpropyl]carbamoyl]-1,3,4,5,6,6a-hexahydrocyclopenta[c]pyrrole-3a-carboxylic acid
CID 122017111
5-[[2-(1-methoxypiperidin-4-yl)acetyl]amino]-1-methylpyrazole-3-carboxylic acid
CID 146102865
3-[[2-(1-methoxypiperidin-4-yl)acetyl]amino]imidazo[1,2-a]pyridine-7-carboxylic acid
CID 146102861

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclohexen-1-yl)-2-methylpropyl]-2-(1-methoxypiperidin-4-yl)acetamide?
The IUPAC name of N-[2-(cyclohexen-1-yl)-2-methylpropyl]-2-(1-methoxypiperidin-4-yl)acetamide (CID 167816633) is N-[2-(cyclohexen-1-yl)-2-methylpropyl]-2-(1-methoxypiperidin-4-yl)acetamide.
What is the SMILES notation for N-[2-(cyclohexen-1-yl)-2-methylpropyl]-2-(1-methoxypiperidin-4-yl)acetamide?
The canonical SMILES for N-[2-(cyclohexen-1-yl)-2-methylpropyl]-2-(1-methoxypiperidin-4-yl)acetamide is CON1CCC(CC(=O)NCC(C)(C)C2=CCCCC2)CC1.
What is the InChIKey of N-[2-(cyclohexen-1-yl)-2-methylpropyl]-2-(1-methoxypiperidin-4-yl)acetamide?
The InChIKey is SCJWQYLHTZMBLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2O2/c1-18(2,16-7-5-4-6-8-16)14-19-17(21)13-15-9-11-20(22-3)12-10-15/h7,15H,4-6,8-14H2,1-3H3,(H,19,21).
What are the key properties of N-[2-(cyclohexen-1-yl)-2-methylpropyl]-2-(1-methoxypiperidin-4-yl)acetamide?
N-[2-(cyclohexen-1-yl)-2-methylpropyl]-2-(1-methoxypiperidin-4-yl)acetamide has a molecular weight of 308.47 g/mol, XLogP of 3.29, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclohexen-1-yl)-2-methylpropyl]-2-(1-methoxypiperidin-4-yl)acetamide is sourced from PubChem (CID 167816633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).