1-[[4-(ethylamino)oxolan-3-yl]methyl]-N,N-dimethylpyrrolidin-3-amine

C13H27N3O — CID 66259336

IUPAC1-[[4-(ethylamino)oxolan-3-yl]methyl]-N,N-dimethylpyrrolidin-3-amine
SMILESCCNC1COCC1CN1CCC(N(C)C)C1
InChIInChI=1S/C13H27N3O/c1-4-14-13-10-17-9-11(13)7-16-6-5-12(8-16)15(2)3/h11-14H,4-10H2,1-3H3
InChIKeyALOMYGPEGGXMSB-UHFFFAOYSA-N
MW241.38 g/mol
LogP0.25
Rot. Bonds5

About 1-[[4-(ethylamino)oxolan-3-yl]methyl]-N,N-dimethylpyrrolidin-3-amine

1-[[4-(ethylamino)oxolan-3-yl]methyl]-N,N-dimethylpyrrolidin-3-amine (PubChem CID 66259336) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is 1-[[4-(ethylamino)oxolan-3-yl]methyl]-N,N-dimethylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-[[4-(ethylamino)oxolan-3-yl]methyl]-N,N-dimethylpyrrolidin-3-amine
PubChem CID66259336
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC Name1-[[4-(ethylamino)oxolan-3-yl]methyl]-N,N-dimethylpyrrolidin-3-amine
SMILESCCNC1COCC1CN1CCC(N(C)C)C1
InChIInChI=1S/C13H27N3O/c1-4-14-13-10-17-9-11(13)7-16-6-5-12(8-16)15(2)3/h11-14H,4-10H2,1-3H3
InChIKeyALOMYGPEGGXMSB-UHFFFAOYSA-N
XLogP0.25
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[[4-(ethylamino)oxolan-3-yl]methyl]-N,N-dimethylpyrrolidin-3-amine?
The IUPAC name of 1-[[4-(ethylamino)oxolan-3-yl]methyl]-N,N-dimethylpyrrolidin-3-amine (CID 66259336) is 1-[[4-(ethylamino)oxolan-3-yl]methyl]-N,N-dimethylpyrrolidin-3-amine.
What is the SMILES notation for 1-[[4-(ethylamino)oxolan-3-yl]methyl]-N,N-dimethylpyrrolidin-3-amine?
The canonical SMILES for 1-[[4-(ethylamino)oxolan-3-yl]methyl]-N,N-dimethylpyrrolidin-3-amine is CCNC1COCC1CN1CCC(N(C)C)C1.
What is the InChIKey of 1-[[4-(ethylamino)oxolan-3-yl]methyl]-N,N-dimethylpyrrolidin-3-amine?
The InChIKey is ALOMYGPEGGXMSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-4-14-13-10-17-9-11(13)7-16-6-5-12(8-16)15(2)3/h11-14H,4-10H2,1-3H3.
What are the key properties of 1-[[4-(ethylamino)oxolan-3-yl]methyl]-N,N-dimethylpyrrolidin-3-amine?
1-[[4-(ethylamino)oxolan-3-yl]methyl]-N,N-dimethylpyrrolidin-3-amine has a molecular weight of 241.38 g/mol, XLogP of 0.25, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[4-(ethylamino)oxolan-3-yl]methyl]-N,N-dimethylpyrrolidin-3-amine is sourced from PubChem (CID 66259336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).