2-[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]ethanamine

C10H22N2O — CID 114802612

IUPAC2-[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]ethanamine
SMILESCOCC(C)N1CCC(CCN)C1
InChIInChI=1S/C10H22N2O/c1-9(8-13-2)12-6-4-10(7-12)3-5-11/h9-10H,3-8,11H2,1-2H3
InChIKeyNDHCBWMHHXHJET-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.69
Rot. Bonds5

About 2-[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]ethanamine

2-[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]ethanamine (PubChem CID 114802612) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 2-[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]ethanamine.

Molecular Properties

Compound Name2-[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]ethanamine
PubChem CID114802612
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name2-[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]ethanamine
SMILESCOCC(C)N1CCC(CCN)C1
InChIInChI=1S/C10H22N2O/c1-9(8-13-2)12-6-4-10(7-12)3-5-11/h9-10H,3-8,11H2,1-2H3
InChIKeyNDHCBWMHHXHJET-UHFFFAOYSA-N
XLogP0.69
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]ethanamine with MolForge

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

Launch Full Analysis

Related Compounds

2-[(3S)-1-propan-2-ylpyrrolidin-3-yl]ethanamine
CID 94058250
N-[[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]methyl]propan-2-amine
CID 62512388
4-[3-(methoxymethyl)pyrrolidin-1-yl]pentan-2-amine
CID 64705792
3-[4-(methoxymethyl)piperidin-1-yl]butan-1-amine
CID 63971694
3-methoxy-2-[3-(methoxymethyl)pyrrolidin-1-yl]propan-1-amine
CID 103226769
2-[3-(2-aminoethyl)pyrrolidin-1-yl]-N-(1-methoxypropan-2-yl)acetamide
CID 114802649
2-[1-(4-methoxybutyl)pyrrolidin-3-yl]ethanamine
CID 114802487
2-[3-(2-aminoethyl)pyrrolidin-1-yl]-N-ethylpropanamide
CID 114802683
2-[3-(2-aminoethyl)pyrrolidin-1-yl]-N-propylpropanamide
CID 114802599
3-amino-4-methoxy-2-(3-propylpyrrolidin-1-yl)butan-1-ol
CID 114357613
2-[3-(aminomethyl)pyrrolidin-1-yl]-N,N-dimethylpropan-1-amine
CID 115492059
N'-hydroxy-3-[3-(methoxymethyl)pyrrolidin-1-yl]butanimidamide
CID 77048476

Frequently Asked Questions

What is the IUPAC name of 2-[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]ethanamine?
The IUPAC name of 2-[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]ethanamine (CID 114802612) is 2-[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]ethanamine.
What is the SMILES notation for 2-[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]ethanamine?
The canonical SMILES for 2-[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]ethanamine is COCC(C)N1CCC(CCN)C1.
What is the InChIKey of 2-[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]ethanamine?
The InChIKey is NDHCBWMHHXHJET-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-9(8-13-2)12-6-4-10(7-12)3-5-11/h9-10H,3-8,11H2,1-2H3.
What are the key properties of 2-[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]ethanamine?
2-[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]ethanamine has a molecular weight of 186.30 g/mol, XLogP of 0.69, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]ethanamine is sourced from PubChem (CID 114802612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).