N,4-diethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide

C15H28N2O2 — CID 114428566

IUPACN,4-diethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)N(CC)CC2CCOC2)C1
InChIInChI=1S/C15H28N2O2/c1-3-12-5-7-16-14(9-12)15(18)17(4-2)10-13-6-8-19-11-13/h12-14,16H,3-11H2,1-2H3
InChIKeyBQPPGDYDMZZFGM-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.65
Rot. Bonds5

About N,4-diethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide

N,4-diethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide (PubChem CID 114428566) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N,4-diethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide.

Molecular Properties

Compound NameN,4-diethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide
PubChem CID114428566
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC NameN,4-diethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)N(CC)CC2CCOC2)C1
InChIInChI=1S/C15H28N2O2/c1-3-12-5-7-16-14(9-12)15(18)17(4-2)10-13-6-8-19-11-13/h12-14,16H,3-11H2,1-2H3
InChIKeyBQPPGDYDMZZFGM-UHFFFAOYSA-N
XLogP1.65
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,4-diethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide?
The IUPAC name of N,4-diethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide (CID 114428566) is N,4-diethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide.
What is the SMILES notation for N,4-diethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide?
The canonical SMILES for N,4-diethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide is CCC1CCNC(C(=O)N(CC)CC2CCOC2)C1.
What is the InChIKey of N,4-diethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide?
The InChIKey is BQPPGDYDMZZFGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-3-12-5-7-16-14(9-12)15(18)17(4-2)10-13-6-8-19-11-13/h12-14,16H,3-11H2,1-2H3.
What are the key properties of N,4-diethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide?
N,4-diethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide has a molecular weight of 268.40 g/mol, XLogP of 1.65, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-diethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide is sourced from PubChem (CID 114428566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).