2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(2-morpholin-2-ylethyl)propan-1-amine

C15H31N3O — CID 115239317

IUPAC2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(2-morpholin-2-ylethyl)propan-1-amine
SMILESCN1CCC(C(C)(C)CNCCC2CNCCO2)C1
InChIInChI=1S/C15H31N3O/c1-15(2,13-5-8-18(3)11-13)12-17-6-4-14-10-16-7-9-19-14/h13-14,16-17H,4-12H2,1-3H3
InChIKeyFPJMJBCAHBLFLS-UHFFFAOYSA-N
MW269.43 g/mol
LogP0.93
Rot. Bonds6

About 2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(2-morpholin-2-ylethyl)propan-1-amine

2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(2-morpholin-2-ylethyl)propan-1-amine (PubChem CID 115239317) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is 2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(2-morpholin-2-ylethyl)propan-1-amine.

Molecular Properties

Compound Name2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(2-morpholin-2-ylethyl)propan-1-amine
PubChem CID115239317
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC Name2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(2-morpholin-2-ylethyl)propan-1-amine
SMILESCN1CCC(C(C)(C)CNCCC2CNCCO2)C1
InChIInChI=1S/C15H31N3O/c1-15(2,13-5-8-18(3)11-13)12-17-6-4-14-10-16-7-9-19-14/h13-14,16-17H,4-12H2,1-3H3
InChIKeyFPJMJBCAHBLFLS-UHFFFAOYSA-N
XLogP0.93
TPSA36.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(2-morpholin-2-ylethyl)propan-1-amine?
The IUPAC name of 2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(2-morpholin-2-ylethyl)propan-1-amine (CID 115239317) is 2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(2-morpholin-2-ylethyl)propan-1-amine.
What is the SMILES notation for 2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(2-morpholin-2-ylethyl)propan-1-amine?
The canonical SMILES for 2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(2-morpholin-2-ylethyl)propan-1-amine is CN1CCC(C(C)(C)CNCCC2CNCCO2)C1.
What is the InChIKey of 2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(2-morpholin-2-ylethyl)propan-1-amine?
The InChIKey is FPJMJBCAHBLFLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-15(2,13-5-8-18(3)11-13)12-17-6-4-14-10-16-7-9-19-14/h13-14,16-17H,4-12H2,1-3H3.
What are the key properties of 2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(2-morpholin-2-ylethyl)propan-1-amine?
2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(2-morpholin-2-ylethyl)propan-1-amine has a molecular weight of 269.43 g/mol, XLogP of 0.93, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(1-methylpyrrolidin-3-yl)-N-(2-morpholin-2-ylethyl)propan-1-amine is sourced from PubChem (CID 115239317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).