N-(2-methoxyethyl)-4-methyl-N-pentan-3-ylpiperidine-2-carboxamide

C15H30N2O2 — CID 114423422

IUPACN-(2-methoxyethyl)-4-methyl-N-pentan-3-ylpiperidine-2-carboxamide
SMILESCCC(CC)N(CCOC)C(=O)C1CC(C)CCN1
InChIInChI=1S/C15H30N2O2/c1-5-13(6-2)17(9-10-19-4)15(18)14-11-12(3)7-8-16-14/h12-14,16H,5-11H2,1-4H3
InChIKeyBYDQBSPFANHJQA-UHFFFAOYSA-N
MW270.42 g/mol
LogP2.04
Rot. Bonds7

About N-(2-methoxyethyl)-4-methyl-N-pentan-3-ylpiperidine-2-carboxamide

N-(2-methoxyethyl)-4-methyl-N-pentan-3-ylpiperidine-2-carboxamide (PubChem CID 114423422) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is N-(2-methoxyethyl)-4-methyl-N-pentan-3-ylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-4-methyl-N-pentan-3-ylpiperidine-2-carboxamide
PubChem CID114423422
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC NameN-(2-methoxyethyl)-4-methyl-N-pentan-3-ylpiperidine-2-carboxamide
SMILESCCC(CC)N(CCOC)C(=O)C1CC(C)CCN1
InChIInChI=1S/C15H30N2O2/c1-5-13(6-2)17(9-10-19-4)15(18)14-11-12(3)7-8-16-14/h12-14,16H,5-11H2,1-4H3
InChIKeyBYDQBSPFANHJQA-UHFFFAOYSA-N
XLogP2.04
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-4-methyl-N-pentan-3-ylpiperidine-2-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-4-methyl-N-pentan-3-ylpiperidine-2-carboxamide (CID 114423422) is N-(2-methoxyethyl)-4-methyl-N-pentan-3-ylpiperidine-2-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-4-methyl-N-pentan-3-ylpiperidine-2-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-4-methyl-N-pentan-3-ylpiperidine-2-carboxamide is CCC(CC)N(CCOC)C(=O)C1CC(C)CCN1.
What is the InChIKey of N-(2-methoxyethyl)-4-methyl-N-pentan-3-ylpiperidine-2-carboxamide?
The InChIKey is BYDQBSPFANHJQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-5-13(6-2)17(9-10-19-4)15(18)14-11-12(3)7-8-16-14/h12-14,16H,5-11H2,1-4H3.
What are the key properties of N-(2-methoxyethyl)-4-methyl-N-pentan-3-ylpiperidine-2-carboxamide?
N-(2-methoxyethyl)-4-methyl-N-pentan-3-ylpiperidine-2-carboxamide has a molecular weight of 270.42 g/mol, XLogP of 2.04, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-4-methyl-N-pentan-3-ylpiperidine-2-carboxamide is sourced from PubChem (CID 114423422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).