2-(cyclohexen-1-yl)-N-ethyl-N-(piperidin-4-ylmethyl)acetamide

C16H28N2O — CID 79721199

IUPAC2-(cyclohexen-1-yl)-N-ethyl-N-(piperidin-4-ylmethyl)acetamide
SMILESCCN(CC1CCNCC1)C(=O)CC1=CCCCC1
InChIInChI=1S/C16H28N2O/c1-2-18(13-15-8-10-17-11-9-15)16(19)12-14-6-4-3-5-7-14/h6,15,17H,2-5,7-13H2,1H3
InChIKeyPZLLVRHVVVRQDZ-UHFFFAOYSA-N
MW264.41 g/mol
LogP2.72
Rot. Bonds5

About 2-(cyclohexen-1-yl)-N-ethyl-N-(piperidin-4-ylmethyl)acetamide

2-(cyclohexen-1-yl)-N-ethyl-N-(piperidin-4-ylmethyl)acetamide (PubChem CID 79721199) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is 2-(cyclohexen-1-yl)-N-ethyl-N-(piperidin-4-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(cyclohexen-1-yl)-N-ethyl-N-(piperidin-4-ylmethyl)acetamide
PubChem CID79721199
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC Name2-(cyclohexen-1-yl)-N-ethyl-N-(piperidin-4-ylmethyl)acetamide
SMILESCCN(CC1CCNCC1)C(=O)CC1=CCCCC1
InChIInChI=1S/C16H28N2O/c1-2-18(13-15-8-10-17-11-9-15)16(19)12-14-6-4-3-5-7-14/h6,15,17H,2-5,7-13H2,1H3
InChIKeyPZLLVRHVVVRQDZ-UHFFFAOYSA-N
XLogP2.72
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(cyclohexen-1-yl)-N-methyl-N-piperidin-4-ylacetamide
CID 63564422
3-cyclohexyl-N-ethyl-N-(piperidin-4-ylmethyl)propanamide
CID 79720313
N-ethyl-2-methyl-N-(piperidin-4-ylmethyl)propanamide
CID 79721124
N-ethyl-4-methyl-N-(piperidin-4-ylmethyl)pentanamide
CID 79720897
2-acetamido-N-ethyl-N-(piperidin-4-ylmethyl)acetamide
CID 79721132
N-ethyl-2,2,3,3-tetramethyl-N-(piperidin-4-ylmethyl)cyclopropane-1-carboxamide
CID 79720902
2-(cyclohexen-1-yl)-N-[(3S)-pyrrolidin-3-yl]acetamide
CID 79688799
2-(2-chloro-6-fluorophenyl)-N-ethyl-N-(piperidin-4-ylmethyl)acetamide
CID 79698350
2-(cyclohexen-1-yl)-N-methyl-N-(2-piperazin-1-ylethyl)acetamide
CID 63565557
N-ethyl-2,6-dihydroxy-N-(piperidin-4-ylmethyl)benzamide
CID 107690375
N-ethyl-N-(piperidin-4-ylmethyl)-2,3-dihydro-1H-indene-5-carboxamide
CID 79700663
2-phenyl-N-(piperidin-4-ylmethyl)-N-propylacetamide
CID 79720329

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexen-1-yl)-N-ethyl-N-(piperidin-4-ylmethyl)acetamide?
The IUPAC name of 2-(cyclohexen-1-yl)-N-ethyl-N-(piperidin-4-ylmethyl)acetamide (CID 79721199) is 2-(cyclohexen-1-yl)-N-ethyl-N-(piperidin-4-ylmethyl)acetamide.
What is the SMILES notation for 2-(cyclohexen-1-yl)-N-ethyl-N-(piperidin-4-ylmethyl)acetamide?
The canonical SMILES for 2-(cyclohexen-1-yl)-N-ethyl-N-(piperidin-4-ylmethyl)acetamide is CCN(CC1CCNCC1)C(=O)CC1=CCCCC1.
What is the InChIKey of 2-(cyclohexen-1-yl)-N-ethyl-N-(piperidin-4-ylmethyl)acetamide?
The InChIKey is PZLLVRHVVVRQDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c1-2-18(13-15-8-10-17-11-9-15)16(19)12-14-6-4-3-5-7-14/h6,15,17H,2-5,7-13H2,1H3.
What are the key properties of 2-(cyclohexen-1-yl)-N-ethyl-N-(piperidin-4-ylmethyl)acetamide?
2-(cyclohexen-1-yl)-N-ethyl-N-(piperidin-4-ylmethyl)acetamide has a molecular weight of 264.41 g/mol, XLogP of 2.72, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexen-1-yl)-N-ethyl-N-(piperidin-4-ylmethyl)acetamide is sourced from PubChem (CID 79721199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).