N'-(2-methoxyethyl)-N'-methyl-N-(2-pyrrolidin-2-ylcyclopentyl)ethane-1,2-diamine

C15H31N3O — CID 79544219

IUPACN'-(2-methoxyethyl)-N'-methyl-N-(2-pyrrolidin-2-ylcyclopentyl)ethane-1,2-diamine
SMILESCOCCN(C)CCNC1CCCC1C1CCCN1
InChIInChI=1S/C15H31N3O/c1-18(11-12-19-2)10-9-17-14-6-3-5-13(14)15-7-4-8-16-15/h13-17H,3-12H2,1-2H3
InChIKeyVNHYHXSWWIWJMF-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.07
Rot. Bonds8

About N'-(2-methoxyethyl)-N'-methyl-N-(2-pyrrolidin-2-ylcyclopentyl)ethane-1,2-diamine

N'-(2-methoxyethyl)-N'-methyl-N-(2-pyrrolidin-2-ylcyclopentyl)ethane-1,2-diamine (PubChem CID 79544219) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is N'-(2-methoxyethyl)-N'-methyl-N-(2-pyrrolidin-2-ylcyclopentyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-(2-methoxyethyl)-N'-methyl-N-(2-pyrrolidin-2-ylcyclopentyl)ethane-1,2-diamine
PubChem CID79544219
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC NameN'-(2-methoxyethyl)-N'-methyl-N-(2-pyrrolidin-2-ylcyclopentyl)ethane-1,2-diamine
SMILESCOCCN(C)CCNC1CCCC1C1CCCN1
InChIInChI=1S/C15H31N3O/c1-18(11-12-19-2)10-9-17-14-6-3-5-13(14)15-7-4-8-16-15/h13-17H,3-12H2,1-2H3
InChIKeyVNHYHXSWWIWJMF-UHFFFAOYSA-N
XLogP1.07
TPSA36.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N'-(2-methoxyethyl)-N'-methyl-N-(2-pyrrolidin-2-ylcyclopentyl)ethane-1,2-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N'-(2-methoxyethyl)-N'-methyl-N-(2-pyrrolidin-2-ylcyclopentyl)ethane-1,2-diamine?
The IUPAC name of N'-(2-methoxyethyl)-N'-methyl-N-(2-pyrrolidin-2-ylcyclopentyl)ethane-1,2-diamine (CID 79544219) is N'-(2-methoxyethyl)-N'-methyl-N-(2-pyrrolidin-2-ylcyclopentyl)ethane-1,2-diamine.
What is the SMILES notation for N'-(2-methoxyethyl)-N'-methyl-N-(2-pyrrolidin-2-ylcyclopentyl)ethane-1,2-diamine?
The canonical SMILES for N'-(2-methoxyethyl)-N'-methyl-N-(2-pyrrolidin-2-ylcyclopentyl)ethane-1,2-diamine is COCCN(C)CCNC1CCCC1C1CCCN1.
What is the InChIKey of N'-(2-methoxyethyl)-N'-methyl-N-(2-pyrrolidin-2-ylcyclopentyl)ethane-1,2-diamine?
The InChIKey is VNHYHXSWWIWJMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-18(11-12-19-2)10-9-17-14-6-3-5-13(14)15-7-4-8-16-15/h13-17H,3-12H2,1-2H3.
What are the key properties of N'-(2-methoxyethyl)-N'-methyl-N-(2-pyrrolidin-2-ylcyclopentyl)ethane-1,2-diamine?
N'-(2-methoxyethyl)-N'-methyl-N-(2-pyrrolidin-2-ylcyclopentyl)ethane-1,2-diamine has a molecular weight of 269.43 g/mol, XLogP of 1.07, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-methoxyethyl)-N'-methyl-N-(2-pyrrolidin-2-ylcyclopentyl)ethane-1,2-diamine is sourced from PubChem (CID 79544219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).