N-(3,5-dimethylcyclohexyl)-2-piperidin-2-ylacetamide

C15H28N2O — CID 64734481

IUPACN-(3,5-dimethylcyclohexyl)-2-piperidin-2-ylacetamide
SMILESCC1CC(C)CC(NC(=O)CC2CCCCN2)C1
InChIInChI=1S/C15H28N2O/c1-11-7-12(2)9-14(8-11)17-15(18)10-13-5-3-4-6-16-13/h11-14,16H,3-10H2,1-2H3,(H,17,18)
InChIKeyXDPBMUWZEKIDNA-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.46
Rot. Bonds3

About N-(3,5-dimethylcyclohexyl)-2-piperidin-2-ylacetamide

N-(3,5-dimethylcyclohexyl)-2-piperidin-2-ylacetamide (PubChem CID 64734481) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is N-(3,5-dimethylcyclohexyl)-2-piperidin-2-ylacetamide.

Molecular Properties

Compound NameN-(3,5-dimethylcyclohexyl)-2-piperidin-2-ylacetamide
PubChem CID64734481
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC NameN-(3,5-dimethylcyclohexyl)-2-piperidin-2-ylacetamide
SMILESCC1CC(C)CC(NC(=O)CC2CCCCN2)C1
InChIInChI=1S/C15H28N2O/c1-11-7-12(2)9-14(8-11)17-15(18)10-13-5-3-4-6-16-13/h11-14,16H,3-10H2,1-2H3,(H,17,18)
InChIKeyXDPBMUWZEKIDNA-UHFFFAOYSA-N
XLogP2.46
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylcyclohexyl)-2-piperidin-2-ylacetamide?
The IUPAC name of N-(3,5-dimethylcyclohexyl)-2-piperidin-2-ylacetamide (CID 64734481) is N-(3,5-dimethylcyclohexyl)-2-piperidin-2-ylacetamide.
What is the SMILES notation for N-(3,5-dimethylcyclohexyl)-2-piperidin-2-ylacetamide?
The canonical SMILES for N-(3,5-dimethylcyclohexyl)-2-piperidin-2-ylacetamide is CC1CC(C)CC(NC(=O)CC2CCCCN2)C1.
What is the InChIKey of N-(3,5-dimethylcyclohexyl)-2-piperidin-2-ylacetamide?
The InChIKey is XDPBMUWZEKIDNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-11-7-12(2)9-14(8-11)17-15(18)10-13-5-3-4-6-16-13/h11-14,16H,3-10H2,1-2H3,(H,17,18).
What are the key properties of N-(3,5-dimethylcyclohexyl)-2-piperidin-2-ylacetamide?
N-(3,5-dimethylcyclohexyl)-2-piperidin-2-ylacetamide has a molecular weight of 252.40 g/mol, XLogP of 2.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylcyclohexyl)-2-piperidin-2-ylacetamide is sourced from PubChem (CID 64734481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).