1-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)cyclobutane-1-carboxamide;hydrochloride

C13H25ClN2O2 — CID 119513563

IUPAC1-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)cyclobutane-1-carboxamide;hydrochloride
SMILESCOCCC1(C(=O)NCC2CCCN2)CCC1.Cl
InChIInChI=1S/C13H24N2O2.ClH/c1-17-9-7-13(5-3-6-13)12(16)15-10-11-4-2-8-14-11;/h11,14H,2-10H2,1H3,(H,15,16);1H
InChIKeyUEQCOQDBOBFRJP-UHFFFAOYSA-N
MW276.81 g/mol
LogP1.48
Rot. Bonds6

About 1-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)cyclobutane-1-carboxamide;hydrochloride

1-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)cyclobutane-1-carboxamide;hydrochloride (PubChem CID 119513563) has the molecular formula C13H25ClN2O2 and a molecular weight of 276.81 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)cyclobutane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)cyclobutane-1-carboxamide;hydrochloride
PubChem CID119513563
Molecular FormulaC13H25ClN2O2
Molecular Weight276.81 g/mol
Exact Mass276.16
IUPAC Name1-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)cyclobutane-1-carboxamide;hydrochloride
SMILESCOCCC1(C(=O)NCC2CCCN2)CCC1.Cl
InChIInChI=1S/C13H24N2O2.ClH/c1-17-9-7-13(5-3-6-13)12(16)15-10-11-4-2-8-14-11;/h11,14H,2-10H2,1H3,(H,15,16);1H
InChIKeyUEQCOQDBOBFRJP-UHFFFAOYSA-N
XLogP1.48
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.81
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)cyclobutane-1-carboxamide
CID 119513564
N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-2-pyrrolidin-2-ylacetamide
CID 119812139
N-(2-aminoethyl)-1-(2-methoxyethyl)cyclobutane-1-carboxamide;hydrochloride
CID 119384705
N-(2-amino-2-methylpropyl)-1-(2-methoxyethyl)cyclobutane-1-carboxamide;hydrochloride
CID 119629491
N-[2-(cycloheptylamino)ethyl]-1-(2-methoxyethyl)cyclobutane-1-carboxamide
CID 119620918
N-(pyrrolidin-2-ylmethyl)adamantane-1-carboxamide
CID 62541274
4-methyl-N-(pyrrolidin-2-ylmethyl)oxane-4-carboxamide
CID 70985299
N-(8-azabicyclo[3.2.1]octan-3-yl)-1-(2-methoxyethyl)cyclobutane-1-carboxamide;hydrochloride
CID 119458530
1-amino-N-(piperidin-2-ylmethyl)cyclopropane-1-carboxamide
CID 130961670
1-methyl-N-(piperidin-2-ylmethyl)cyclohexane-1-carboxamide
CID 106826694
N-(3-aminobutyl)-1-(2-methoxyethyl)cyclobutane-1-carboxamide;hydrochloride
CID 119498511
N-[(2R)-2-(ethylamino)propyl]-1-(2-methoxyethyl)cyclobutane-1-carboxamide;hydrochloride
CID 120654180

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)cyclobutane-1-carboxamide;hydrochloride?
The IUPAC name of 1-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)cyclobutane-1-carboxamide;hydrochloride (CID 119513563) is 1-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)cyclobutane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)cyclobutane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)cyclobutane-1-carboxamide;hydrochloride is COCCC1(C(=O)NCC2CCCN2)CCC1.Cl.
What is the InChIKey of 1-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)cyclobutane-1-carboxamide;hydrochloride?
The InChIKey is UEQCOQDBOBFRJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2.ClH/c1-17-9-7-13(5-3-6-13)12(16)15-10-11-4-2-8-14-11;/h11,14H,2-10H2,1H3,(H,15,16);1H.
What are the key properties of 1-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)cyclobutane-1-carboxamide;hydrochloride?
1-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)cyclobutane-1-carboxamide;hydrochloride has a molecular weight of 276.81 g/mol, XLogP of 1.48, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)cyclobutane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119513563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).