2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-propan-2-ylacetamide

C17H30N2O2 — CID 46295192

IUPAC2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CC1CCN(C(=O)C2CCCCC2)CC1
InChIInChI=1S/C17H30N2O2/c1-13(2)18-16(20)12-14-8-10-19(11-9-14)17(21)15-6-4-3-5-7-15/h13-15H,3-12H2,1-2H3,(H,18,20)
InChIKeyHJQDFWKWXLYNKJ-UHFFFAOYSA-N
MW294.44 g/mol
LogP2.72
Rot. Bonds4

About 2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-propan-2-ylacetamide

2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-propan-2-ylacetamide (PubChem CID 46295192) has the molecular formula C17H30N2O2 and a molecular weight of 294.44 g/mol. Its IUPAC name is 2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-propan-2-ylacetamide
PubChem CID46295192
Molecular FormulaC17H30N2O2
Molecular Weight294.44 g/mol
Exact Mass294.23
IUPAC Name2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CC1CCN(C(=O)C2CCCCC2)CC1
InChIInChI=1S/C17H30N2O2/c1-13(2)18-16(20)12-14-8-10-19(11-9-14)17(21)15-6-4-3-5-7-15/h13-15H,3-12H2,1-2H3,(H,18,20)
InChIKeyHJQDFWKWXLYNKJ-UHFFFAOYSA-N
XLogP2.72
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-propan-2-ylacetamide?
The IUPAC name of 2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-propan-2-ylacetamide (CID 46295192) is 2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-propan-2-ylacetamide is CC(C)NC(=O)CC1CCN(C(=O)C2CCCCC2)CC1.
What is the InChIKey of 2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-propan-2-ylacetamide?
The InChIKey is HJQDFWKWXLYNKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O2/c1-13(2)18-16(20)12-14-8-10-19(11-9-14)17(21)15-6-4-3-5-7-15/h13-15H,3-12H2,1-2H3,(H,18,20).
What are the key properties of 2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-propan-2-ylacetamide?
2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-propan-2-ylacetamide has a molecular weight of 294.44 g/mol, XLogP of 2.72, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-propan-2-ylacetamide is sourced from PubChem (CID 46295192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).