1-(2-methylpropyl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide

C15H28N2O2 — CID 3148915

IUPAC1-(2-methylpropyl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide
SMILESCC(C)CN1CCC(C(=O)NCC2CCCO2)CC1
InChIInChI=1S/C15H28N2O2/c1-12(2)11-17-7-5-13(6-8-17)15(18)16-10-14-4-3-9-19-14/h12-14H,3-11H2,1-2H3,(H,16,18)
InChIKeyBMKRXSMMNJGRCG-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.65
Rot. Bonds5

About 1-(2-methylpropyl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide

1-(2-methylpropyl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide (PubChem CID 3148915) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 1-(2-methylpropyl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-methylpropyl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide
PubChem CID3148915
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name1-(2-methylpropyl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide
SMILESCC(C)CN1CCC(C(=O)NCC2CCCO2)CC1
InChIInChI=1S/C15H28N2O2/c1-12(2)11-17-7-5-13(6-8-17)15(18)16-10-14-4-3-9-19-14/h12-14H,3-11H2,1-2H3,(H,16,18)
InChIKeyBMKRXSMMNJGRCG-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 1-(2-methylpropyl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide?
The IUPAC name of 1-(2-methylpropyl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide (CID 3148915) is 1-(2-methylpropyl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(2-methylpropyl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(2-methylpropyl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide is CC(C)CN1CCC(C(=O)NCC2CCCO2)CC1.
What is the InChIKey of 1-(2-methylpropyl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide?
The InChIKey is BMKRXSMMNJGRCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-12(2)11-17-7-5-13(6-8-17)15(18)16-10-14-4-3-9-19-14/h12-14H,3-11H2,1-2H3,(H,16,18).
What are the key properties of 1-(2-methylpropyl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide?
1-(2-methylpropyl)-N-(oxolan-2-ylmethyl)piperidine-4-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 1-(2-methylpropyl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide is sourced from PubChem (CID 3148915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).