2-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2-methylcyclopentan-1-amine

C15H32N2O — CID 82767668

IUPAC2-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2-methylcyclopentan-1-amine
SMILESCCC(CC)N(CCOC)CC1(C)CCCC1N
InChIInChI=1S/C15H32N2O/c1-5-13(6-2)17(10-11-18-4)12-15(3)9-7-8-14(15)16/h13-14H,5-12,16H2,1-4H3
InChIKeySEYXFHPEMLRHHH-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.64
Rot. Bonds8

About 2-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2-methylcyclopentan-1-amine

2-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2-methylcyclopentan-1-amine (PubChem CID 82767668) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is 2-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2-methylcyclopentan-1-amine.

Molecular Properties

Compound Name2-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2-methylcyclopentan-1-amine
PubChem CID82767668
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Name2-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2-methylcyclopentan-1-amine
SMILESCCC(CC)N(CCOC)CC1(C)CCCC1N
InChIInChI=1S/C15H32N2O/c1-5-13(6-2)17(10-11-18-4)12-15(3)9-7-8-14(15)16/h13-14H,5-12,16H2,1-4H3
InChIKeySEYXFHPEMLRHHH-UHFFFAOYSA-N
XLogP2.64
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2-methylcyclopentan-1-amine?
The IUPAC name of 2-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2-methylcyclopentan-1-amine (CID 82767668) is 2-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2-methylcyclopentan-1-amine.
What is the SMILES notation for 2-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2-methylcyclopentan-1-amine?
The canonical SMILES for 2-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2-methylcyclopentan-1-amine is CCC(CC)N(CCOC)CC1(C)CCCC1N.
What is the InChIKey of 2-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2-methylcyclopentan-1-amine?
The InChIKey is SEYXFHPEMLRHHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-5-13(6-2)17(10-11-18-4)12-15(3)9-7-8-14(15)16/h13-14H,5-12,16H2,1-4H3.
What are the key properties of 2-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2-methylcyclopentan-1-amine?
2-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2-methylcyclopentan-1-amine has a molecular weight of 256.43 g/mol, XLogP of 2.64, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2-methylcyclopentan-1-amine is sourced from PubChem (CID 82767668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).