N-methyl-N-(oxolan-2-ylmethyl)-3-piperidin-4-ylpropanamide

C14H26N2O2 — CID 55047975

IUPACN-methyl-N-(oxolan-2-ylmethyl)-3-piperidin-4-ylpropanamide
SMILESCN(CC1CCCO1)C(=O)CCC1CCNCC1
InChIInChI=1S/C14H26N2O2/c1-16(11-13-3-2-10-18-13)14(17)5-4-12-6-8-15-9-7-12/h12-13,15H,2-11H2,1H3
InChIKeyXZSWXDKXAPQWEI-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.40
Rot. Bonds5

About N-methyl-N-(oxolan-2-ylmethyl)-3-piperidin-4-ylpropanamide

N-methyl-N-(oxolan-2-ylmethyl)-3-piperidin-4-ylpropanamide (PubChem CID 55047975) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is N-methyl-N-(oxolan-2-ylmethyl)-3-piperidin-4-ylpropanamide.

Molecular Properties

Compound NameN-methyl-N-(oxolan-2-ylmethyl)-3-piperidin-4-ylpropanamide
PubChem CID55047975
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC NameN-methyl-N-(oxolan-2-ylmethyl)-3-piperidin-4-ylpropanamide
SMILESCN(CC1CCCO1)C(=O)CCC1CCNCC1
InChIInChI=1S/C14H26N2O2/c1-16(11-13-3-2-10-18-13)14(17)5-4-12-6-8-15-9-7-12/h12-13,15H,2-11H2,1H3
InChIKeyXZSWXDKXAPQWEI-UHFFFAOYSA-N
XLogP1.40
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(oxolan-2-ylmethyl)-3-piperidin-4-ylpropanamide?
The IUPAC name of N-methyl-N-(oxolan-2-ylmethyl)-3-piperidin-4-ylpropanamide (CID 55047975) is N-methyl-N-(oxolan-2-ylmethyl)-3-piperidin-4-ylpropanamide.
What is the SMILES notation for N-methyl-N-(oxolan-2-ylmethyl)-3-piperidin-4-ylpropanamide?
The canonical SMILES for N-methyl-N-(oxolan-2-ylmethyl)-3-piperidin-4-ylpropanamide is CN(CC1CCCO1)C(=O)CCC1CCNCC1.
What is the InChIKey of N-methyl-N-(oxolan-2-ylmethyl)-3-piperidin-4-ylpropanamide?
The InChIKey is XZSWXDKXAPQWEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-16(11-13-3-2-10-18-13)14(17)5-4-12-6-8-15-9-7-12/h12-13,15H,2-11H2,1H3.
What are the key properties of N-methyl-N-(oxolan-2-ylmethyl)-3-piperidin-4-ylpropanamide?
N-methyl-N-(oxolan-2-ylmethyl)-3-piperidin-4-ylpropanamide has a molecular weight of 254.37 g/mol, XLogP of 1.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(oxolan-2-ylmethyl)-3-piperidin-4-ylpropanamide is sourced from PubChem (CID 55047975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).