2-methyl-N-[1-[1-(2-pyrrolidin-1-ylethoxy)ethoxy]propan-2-yl]propan-2-amine

C15H32N2O2 — CID 70527370

IUPAC2-methyl-N-[1-[1-(2-pyrrolidin-1-ylethoxy)ethoxy]propan-2-yl]propan-2-amine
SMILESCC(COC(C)OCCN1CCCC1)NC(C)(C)C
InChIInChI=1S/C15H32N2O2/c1-13(16-15(3,4)5)12-19-14(2)18-11-10-17-8-6-7-9-17/h13-14,16H,6-12H2,1-5H3
InChIKeyMNNZZGOGOLBLSI-UHFFFAOYSA-N
MW272.43 g/mol
LogP2.24
Rot. Bonds8

About 2-methyl-N-[1-[1-(2-pyrrolidin-1-ylethoxy)ethoxy]propan-2-yl]propan-2-amine

2-methyl-N-[1-[1-(2-pyrrolidin-1-ylethoxy)ethoxy]propan-2-yl]propan-2-amine (PubChem CID 70527370) has the molecular formula C15H32N2O2 and a molecular weight of 272.43 g/mol. Its IUPAC name is 2-methyl-N-[1-[1-(2-pyrrolidin-1-ylethoxy)ethoxy]propan-2-yl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[1-[1-(2-pyrrolidin-1-ylethoxy)ethoxy]propan-2-yl]propan-2-amine
PubChem CID70527370
Molecular FormulaC15H32N2O2
Molecular Weight272.43 g/mol
Exact Mass272.25
IUPAC Name2-methyl-N-[1-[1-(2-pyrrolidin-1-ylethoxy)ethoxy]propan-2-yl]propan-2-amine
SMILESCC(COC(C)OCCN1CCCC1)NC(C)(C)C
InChIInChI=1S/C15H32N2O2/c1-13(16-15(3,4)5)12-19-14(2)18-11-10-17-8-6-7-9-17/h13-14,16H,6-12H2,1-5H3
InChIKeyMNNZZGOGOLBLSI-UHFFFAOYSA-N
XLogP2.24
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.43
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[1-[1-(2-pyrrolidin-1-ylethoxy)ethoxy]propan-2-yl]propan-2-amine?
The IUPAC name of 2-methyl-N-[1-[1-(2-pyrrolidin-1-ylethoxy)ethoxy]propan-2-yl]propan-2-amine (CID 70527370) is 2-methyl-N-[1-[1-(2-pyrrolidin-1-ylethoxy)ethoxy]propan-2-yl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[1-[1-(2-pyrrolidin-1-ylethoxy)ethoxy]propan-2-yl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[1-[1-(2-pyrrolidin-1-ylethoxy)ethoxy]propan-2-yl]propan-2-amine is CC(COC(C)OCCN1CCCC1)NC(C)(C)C.
What is the InChIKey of 2-methyl-N-[1-[1-(2-pyrrolidin-1-ylethoxy)ethoxy]propan-2-yl]propan-2-amine?
The InChIKey is MNNZZGOGOLBLSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O2/c1-13(16-15(3,4)5)12-19-14(2)18-11-10-17-8-6-7-9-17/h13-14,16H,6-12H2,1-5H3.
What are the key properties of 2-methyl-N-[1-[1-(2-pyrrolidin-1-ylethoxy)ethoxy]propan-2-yl]propan-2-amine?
2-methyl-N-[1-[1-(2-pyrrolidin-1-ylethoxy)ethoxy]propan-2-yl]propan-2-amine has a molecular weight of 272.43 g/mol, XLogP of 2.24, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[1-[1-(2-pyrrolidin-1-ylethoxy)ethoxy]propan-2-yl]propan-2-amine is sourced from PubChem (CID 70527370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).