1-[(1-ethylpyrrolidin-2-yl)methylamino]-2-methylpropan-2-ol

C11H24N2O — CID 60883990

IUPAC1-[(1-ethylpyrrolidin-2-yl)methylamino]-2-methylpropan-2-ol
SMILESCCN1CCCC1CNCC(C)(C)O
InChIInChI=1S/C11H24N2O/c1-4-13-7-5-6-10(13)8-12-9-11(2,3)14/h10,12,14H,4-9H2,1-3H3
InChIKeyNYXWBQXNXSPXEM-UHFFFAOYSA-N
MW200.33 g/mol
LogP0.83
Rot. Bonds5

About 1-[(1-ethylpyrrolidin-2-yl)methylamino]-2-methylpropan-2-ol

1-[(1-ethylpyrrolidin-2-yl)methylamino]-2-methylpropan-2-ol (PubChem CID 60883990) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 1-[(1-ethylpyrrolidin-2-yl)methylamino]-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-[(1-ethylpyrrolidin-2-yl)methylamino]-2-methylpropan-2-ol
PubChem CID60883990
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name1-[(1-ethylpyrrolidin-2-yl)methylamino]-2-methylpropan-2-ol
SMILESCCN1CCCC1CNCC(C)(C)O
InChIInChI=1S/C11H24N2O/c1-4-13-7-5-6-10(13)8-12-9-11(2,3)14/h10,12,14H,4-9H2,1-3H3
InChIKeyNYXWBQXNXSPXEM-UHFFFAOYSA-N
XLogP0.83
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[(1-ethylpyrrolidin-2-yl)methylamino]-2-methylpropan-2-ol 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 1-[(1-ethylpyrrolidin-2-yl)methylamino]-2-methylpropan-2-ol?
The IUPAC name of 1-[(1-ethylpyrrolidin-2-yl)methylamino]-2-methylpropan-2-ol (CID 60883990) is 1-[(1-ethylpyrrolidin-2-yl)methylamino]-2-methylpropan-2-ol.
What is the SMILES notation for 1-[(1-ethylpyrrolidin-2-yl)methylamino]-2-methylpropan-2-ol?
The canonical SMILES for 1-[(1-ethylpyrrolidin-2-yl)methylamino]-2-methylpropan-2-ol is CCN1CCCC1CNCC(C)(C)O.
What is the InChIKey of 1-[(1-ethylpyrrolidin-2-yl)methylamino]-2-methylpropan-2-ol?
The InChIKey is NYXWBQXNXSPXEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-4-13-7-5-6-10(13)8-12-9-11(2,3)14/h10,12,14H,4-9H2,1-3H3.
What are the key properties of 1-[(1-ethylpyrrolidin-2-yl)methylamino]-2-methylpropan-2-ol?
1-[(1-ethylpyrrolidin-2-yl)methylamino]-2-methylpropan-2-ol has a molecular weight of 200.33 g/mol, XLogP of 0.83, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-ethylpyrrolidin-2-yl)methylamino]-2-methylpropan-2-ol is sourced from PubChem (CID 60883990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).