4-ethyl-N-(3-methylpentan-3-yl)piperidine-4-carboxamide

C14H28N2O — CID 106328694

IUPAC4-ethyl-N-(3-methylpentan-3-yl)piperidine-4-carboxamide
SMILESCCC(C)(CC)NC(=O)C1(CC)CCNCC1
InChIInChI=1S/C14H28N2O/c1-5-13(4,6-2)16-12(17)14(7-3)8-10-15-11-9-14/h15H,5-11H2,1-4H3,(H,16,17)
InChIKeyAYRVOVKCLGZLRV-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.46
Rot. Bonds5

About 4-ethyl-N-(3-methylpentan-3-yl)piperidine-4-carboxamide

4-ethyl-N-(3-methylpentan-3-yl)piperidine-4-carboxamide (PubChem CID 106328694) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 4-ethyl-N-(3-methylpentan-3-yl)piperidine-4-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-(3-methylpentan-3-yl)piperidine-4-carboxamide
PubChem CID106328694
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name4-ethyl-N-(3-methylpentan-3-yl)piperidine-4-carboxamide
SMILESCCC(C)(CC)NC(=O)C1(CC)CCNCC1
InChIInChI=1S/C14H28N2O/c1-5-13(4,6-2)16-12(17)14(7-3)8-10-15-11-9-14/h15H,5-11H2,1-4H3,(H,16,17)
InChIKeyAYRVOVKCLGZLRV-UHFFFAOYSA-N
XLogP2.46
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(3-methylpentan-3-yl)piperidine-4-carboxamide?
The IUPAC name of 4-ethyl-N-(3-methylpentan-3-yl)piperidine-4-carboxamide (CID 106328694) is 4-ethyl-N-(3-methylpentan-3-yl)piperidine-4-carboxamide.
What is the SMILES notation for 4-ethyl-N-(3-methylpentan-3-yl)piperidine-4-carboxamide?
The canonical SMILES for 4-ethyl-N-(3-methylpentan-3-yl)piperidine-4-carboxamide is CCC(C)(CC)NC(=O)C1(CC)CCNCC1.
What is the InChIKey of 4-ethyl-N-(3-methylpentan-3-yl)piperidine-4-carboxamide?
The InChIKey is AYRVOVKCLGZLRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-5-13(4,6-2)16-12(17)14(7-3)8-10-15-11-9-14/h15H,5-11H2,1-4H3,(H,16,17).
What are the key properties of 4-ethyl-N-(3-methylpentan-3-yl)piperidine-4-carboxamide?
4-ethyl-N-(3-methylpentan-3-yl)piperidine-4-carboxamide has a molecular weight of 240.39 g/mol, XLogP of 2.46, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(3-methylpentan-3-yl)piperidine-4-carboxamide is sourced from PubChem (CID 106328694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).