3-cyclobutyl-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]propanamide

C15H28N2O2 — CID 131900683

IUPAC3-cyclobutyl-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]propanamide
SMILESCOCCN1CCC(CNC(=O)CCC2CCC2)C1
InChIInChI=1S/C15H28N2O2/c1-19-10-9-17-8-7-14(12-17)11-16-15(18)6-5-13-3-2-4-13/h13-14H,2-12H2,1H3,(H,16,18)
InChIKeyNMQRRYFIMCQODF-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.65
Rot. Bonds8

About 3-cyclobutyl-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]propanamide

3-cyclobutyl-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]propanamide (PubChem CID 131900683) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 3-cyclobutyl-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]propanamide.

Molecular Properties

Compound Name3-cyclobutyl-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]propanamide
PubChem CID131900683
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name3-cyclobutyl-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]propanamide
SMILESCOCCN1CCC(CNC(=O)CCC2CCC2)C1
InChIInChI=1S/C15H28N2O2/c1-19-10-9-17-8-7-14(12-17)11-16-15(18)6-5-13-3-2-4-13/h13-14H,2-12H2,1H3,(H,16,18)
InChIKeyNMQRRYFIMCQODF-UHFFFAOYSA-N
XLogP1.65
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
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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Related Compounds

N-[[(3R)-1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-3-(1-methylpyrazol-4-yl)propanamide
CID 129369601
2-(4-ethylpiperazin-1-yl)-N-[[1-(2-methoxyethyl)piperidin-3-yl]methyl]acetamide;formic acid
CID 154907400
N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-2-(4-methylpyrazol-1-yl)acetamide
CID 91836659
4-bromo-N-[[(3S)-1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]benzamide
CID 95238744
N-[[(3S)-1-cyclopentylpyrrolidin-3-yl]methyl]-3-methoxypropanamide
CID 125446366
N-[[(3S)-1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-4-(2-phenylethyl)piperidine-1-carboxamide
CID 126449856
3-bromo-N-[(1-propylpyrrolidin-3-yl)methyl]propanamide
CID 82109941
2-(3-hydroxy-1-adamantyl)-N-[[1-(2-methoxyethyl)piperidin-3-yl]methyl]acetamide
CID 131911363
N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-3-(4-methylpyrazol-1-yl)propanamide
CID 71880008
N-[[(3S)-1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-2-(methoxymethyl)benzamide
CID 95238690
2-acetyl-N-[[(3R)-1-(2-methoxyethyl)piperidin-3-yl]methyl]benzamide
CID 124758814
N-[[1-(2-methoxyethyl)piperidin-3-yl]methyl]propan-1-amine
CID 62581675

Frequently Asked Questions

What is the IUPAC name of 3-cyclobutyl-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]propanamide?
The IUPAC name of 3-cyclobutyl-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]propanamide (CID 131900683) is 3-cyclobutyl-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]propanamide.
What is the SMILES notation for 3-cyclobutyl-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]propanamide?
The canonical SMILES for 3-cyclobutyl-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]propanamide is COCCN1CCC(CNC(=O)CCC2CCC2)C1.
What is the InChIKey of 3-cyclobutyl-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]propanamide?
The InChIKey is NMQRRYFIMCQODF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-19-10-9-17-8-7-14(12-17)11-16-15(18)6-5-13-3-2-4-13/h13-14H,2-12H2,1H3,(H,16,18).
What are the key properties of 3-cyclobutyl-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]propanamide?
3-cyclobutyl-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]propanamide has a molecular weight of 268.40 g/mol, XLogP of 1.65, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutyl-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]propanamide is sourced from PubChem (CID 131900683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).