2-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)cyclobutan-1-amine

C15H30N2O2 — CID 80998461

IUPAC2-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)cyclobutan-1-amine
SMILESCOCCN(C(C)COC)C1CCC1CNC1CC1
InChIInChI=1S/C15H30N2O2/c1-12(11-19-3)17(8-9-18-2)15-7-4-13(15)10-16-14-5-6-14/h12-16H,4-11H2,1-3H3
InChIKeyJUICEWDMZRNVRR-UHFFFAOYSA-N
MW270.42 g/mol
LogP1.50
Rot. Bonds10

About 2-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)cyclobutan-1-amine

2-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)cyclobutan-1-amine (PubChem CID 80998461) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 2-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)cyclobutan-1-amine.

Molecular Properties

Compound Name2-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)cyclobutan-1-amine
PubChem CID80998461
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Name2-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)cyclobutan-1-amine
SMILESCOCCN(C(C)COC)C1CCC1CNC1CC1
InChIInChI=1S/C15H30N2O2/c1-12(11-19-3)17(8-9-18-2)15-7-4-13(15)10-16-14-5-6-14/h12-16H,4-11H2,1-3H3
InChIKeyJUICEWDMZRNVRR-UHFFFAOYSA-N
XLogP1.50
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)cyclobutan-1-amine?
The IUPAC name of 2-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)cyclobutan-1-amine (CID 80998461) is 2-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)cyclobutan-1-amine.
What is the SMILES notation for 2-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)cyclobutan-1-amine?
The canonical SMILES for 2-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)cyclobutan-1-amine is COCCN(C(C)COC)C1CCC1CNC1CC1.
What is the InChIKey of 2-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)cyclobutan-1-amine?
The InChIKey is JUICEWDMZRNVRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-12(11-19-3)17(8-9-18-2)15-7-4-13(15)10-16-14-5-6-14/h12-16H,4-11H2,1-3H3.
What are the key properties of 2-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)cyclobutan-1-amine?
2-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)cyclobutan-1-amine has a molecular weight of 270.42 g/mol, XLogP of 1.50, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)cyclobutan-1-amine is sourced from PubChem (CID 80998461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).