1-[(3-ethoxycyclobutyl)methyl]-2-(methoxymethyl)pyrrolidine-2-carboxamide

C14H26N2O3 — CID 167911387

IUPAC1-[(3-ethoxycyclobutyl)methyl]-2-(methoxymethyl)pyrrolidine-2-carboxamide
SMILESCCOC1CC(CN2CCCC2(COC)C(N)=O)C1
InChIInChI=1S/C14H26N2O3/c1-3-19-12-7-11(8-12)9-16-6-4-5-14(16,10-18-2)13(15)17/h11-12H,3-10H2,1-2H3,(H2,15,17)
InChIKeyCZOMCTKOWGJKSZ-UHFFFAOYSA-N
MW270.37 g/mol
LogP0.77
Rot. Bonds7

About 1-[(3-ethoxycyclobutyl)methyl]-2-(methoxymethyl)pyrrolidine-2-carboxamide

1-[(3-ethoxycyclobutyl)methyl]-2-(methoxymethyl)pyrrolidine-2-carboxamide (PubChem CID 167911387) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is 1-[(3-ethoxycyclobutyl)methyl]-2-(methoxymethyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-[(3-ethoxycyclobutyl)methyl]-2-(methoxymethyl)pyrrolidine-2-carboxamide
PubChem CID167911387
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC Name1-[(3-ethoxycyclobutyl)methyl]-2-(methoxymethyl)pyrrolidine-2-carboxamide
SMILESCCOC1CC(CN2CCCC2(COC)C(N)=O)C1
InChIInChI=1S/C14H26N2O3/c1-3-19-12-7-11(8-12)9-16-6-4-5-14(16,10-18-2)13(15)17/h11-12H,3-10H2,1-2H3,(H2,15,17)
InChIKeyCZOMCTKOWGJKSZ-UHFFFAOYSA-N
XLogP0.77
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-1-[(3-methylcyclobutyl)methyl]pyrrolidine-2-carboxamide
CID 123486269
1-[2-(2,6-dimethylphenoxy)ethyl]-2-(methoxymethyl)pyrrolidine-2-carboxamide
CID 154742987
2-(3-ethoxycyclobutyl)-1-piperidin-1-ylethanone
CID 103164590
2-(methoxymethyl)-1-[(1S)-1-phenylethyl]pyrrolidine-2-carboxamide
CID 141285069
2-[1-[2-(dimethylamino)-2-oxoethyl]-2-(methoxymethyl)pyrrolidin-2-yl]acetamide
CID 132962235
2-(3-ethoxycyclobutyl)-1-(3-hydroxyazetidin-1-yl)ethanone
CID 103164675
1-[(3-methylcyclohexyl)methyl]-2-propylpyrrolidine-2-carboxylic acid
CID 106979297
1-(1,4-dioxa-9-azaspiro[4.5]decan-9-yl)-2-(3-ethoxycyclobutyl)ethanone
CID 103163779
2-(3-ethoxycyclobutyl)-N-[1-(hydroxymethyl)cyclobutyl]acetamide
CID 103164769
[1-(3-ethoxycyclopentyl)-2-methylpropan-2-yl] carbamate
CID 142924239
1-(2-bicyclo[2.2.1]heptanylmethyl)-2-ethylpyrrolidine-2-carboxylic acid
CID 83080184
1-[4-(1-aminoethyl)piperidin-1-yl]-2-(3-ethoxycyclobutyl)ethanone
CID 103164939

Frequently Asked Questions

What is the IUPAC name of 1-[(3-ethoxycyclobutyl)methyl]-2-(methoxymethyl)pyrrolidine-2-carboxamide?
The IUPAC name of 1-[(3-ethoxycyclobutyl)methyl]-2-(methoxymethyl)pyrrolidine-2-carboxamide (CID 167911387) is 1-[(3-ethoxycyclobutyl)methyl]-2-(methoxymethyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-[(3-ethoxycyclobutyl)methyl]-2-(methoxymethyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 1-[(3-ethoxycyclobutyl)methyl]-2-(methoxymethyl)pyrrolidine-2-carboxamide is CCOC1CC(CN2CCCC2(COC)C(N)=O)C1.
What is the InChIKey of 1-[(3-ethoxycyclobutyl)methyl]-2-(methoxymethyl)pyrrolidine-2-carboxamide?
The InChIKey is CZOMCTKOWGJKSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-3-19-12-7-11(8-12)9-16-6-4-5-14(16,10-18-2)13(15)17/h11-12H,3-10H2,1-2H3,(H2,15,17).
What are the key properties of 1-[(3-ethoxycyclobutyl)methyl]-2-(methoxymethyl)pyrrolidine-2-carboxamide?
1-[(3-ethoxycyclobutyl)methyl]-2-(methoxymethyl)pyrrolidine-2-carboxamide has a molecular weight of 270.37 g/mol, XLogP of 0.77, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-ethoxycyclobutyl)methyl]-2-(methoxymethyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 167911387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).