N-[(2-ethyloxolan-3-yl)methyl]-4-methylpiperidine-2-carboxamide

C14H26N2O2 — CID 114105746

IUPACN-[(2-ethyloxolan-3-yl)methyl]-4-methylpiperidine-2-carboxamide
SMILESCCC1OCCC1CNC(=O)C1CC(C)CCN1
InChIInChI=1S/C14H26N2O2/c1-3-13-11(5-7-18-13)9-16-14(17)12-8-10(2)4-6-15-12/h10-13,15H,3-9H2,1-2H3,(H,16,17)
InChIKeyJNHDXLGCPCMGRE-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.31
Rot. Bonds4

About N-[(2-ethyloxolan-3-yl)methyl]-4-methylpiperidine-2-carboxamide

N-[(2-ethyloxolan-3-yl)methyl]-4-methylpiperidine-2-carboxamide (PubChem CID 114105746) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is N-[(2-ethyloxolan-3-yl)methyl]-4-methylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-[(2-ethyloxolan-3-yl)methyl]-4-methylpiperidine-2-carboxamide
PubChem CID114105746
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC NameN-[(2-ethyloxolan-3-yl)methyl]-4-methylpiperidine-2-carboxamide
SMILESCCC1OCCC1CNC(=O)C1CC(C)CCN1
InChIInChI=1S/C14H26N2O2/c1-3-13-11(5-7-18-13)9-16-14(17)12-8-10(2)4-6-15-12/h10-13,15H,3-9H2,1-2H3,(H,16,17)
InChIKeyJNHDXLGCPCMGRE-UHFFFAOYSA-N
XLogP1.31
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(2-ethyloxolan-3-yl)methyl]-4-methylpiperidine-2-carboxamide?
The IUPAC name of N-[(2-ethyloxolan-3-yl)methyl]-4-methylpiperidine-2-carboxamide (CID 114105746) is N-[(2-ethyloxolan-3-yl)methyl]-4-methylpiperidine-2-carboxamide.
What is the SMILES notation for N-[(2-ethyloxolan-3-yl)methyl]-4-methylpiperidine-2-carboxamide?
The canonical SMILES for N-[(2-ethyloxolan-3-yl)methyl]-4-methylpiperidine-2-carboxamide is CCC1OCCC1CNC(=O)C1CC(C)CCN1.
What is the InChIKey of N-[(2-ethyloxolan-3-yl)methyl]-4-methylpiperidine-2-carboxamide?
The InChIKey is JNHDXLGCPCMGRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-3-13-11(5-7-18-13)9-16-14(17)12-8-10(2)4-6-15-12/h10-13,15H,3-9H2,1-2H3,(H,16,17).
What are the key properties of N-[(2-ethyloxolan-3-yl)methyl]-4-methylpiperidine-2-carboxamide?
N-[(2-ethyloxolan-3-yl)methyl]-4-methylpiperidine-2-carboxamide has a molecular weight of 254.37 g/mol, XLogP of 1.31, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethyloxolan-3-yl)methyl]-4-methylpiperidine-2-carboxamide is sourced from PubChem (CID 114105746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).