N,N-diethyl-1-[3-methoxy-2-(propylamino)propyl]pyrrolidin-3-amine

C15H33N3O — CID 107505722

IUPACN,N-diethyl-1-[3-methoxy-2-(propylamino)propyl]pyrrolidin-3-amine
SMILESCCCNC(COC)CN1CCC(N(CC)CC)C1
InChIInChI=1S/C15H33N3O/c1-5-9-16-14(13-19-4)11-17-10-8-15(12-17)18(6-2)7-3/h14-16H,5-13H2,1-4H3
InChIKeyUJJVVBGWUIHVFO-UHFFFAOYSA-N
MW271.45 g/mol
LogP1.42
Rot. Bonds10

About N,N-diethyl-1-[3-methoxy-2-(propylamino)propyl]pyrrolidin-3-amine

N,N-diethyl-1-[3-methoxy-2-(propylamino)propyl]pyrrolidin-3-amine (PubChem CID 107505722) has the molecular formula C15H33N3O and a molecular weight of 271.45 g/mol. Its IUPAC name is N,N-diethyl-1-[3-methoxy-2-(propylamino)propyl]pyrrolidin-3-amine.

Molecular Properties

Compound NameN,N-diethyl-1-[3-methoxy-2-(propylamino)propyl]pyrrolidin-3-amine
PubChem CID107505722
Molecular FormulaC15H33N3O
Molecular Weight271.45 g/mol
Exact Mass271.26
IUPAC NameN,N-diethyl-1-[3-methoxy-2-(propylamino)propyl]pyrrolidin-3-amine
SMILESCCCNC(COC)CN1CCC(N(CC)CC)C1
InChIInChI=1S/C15H33N3O/c1-5-9-16-14(13-19-4)11-17-10-8-15(12-17)18(6-2)7-3/h14-16H,5-13H2,1-4H3
InChIKeyUJJVVBGWUIHVFO-UHFFFAOYSA-N
XLogP1.42
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.45
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[3-methoxy-2-(propylamino)propyl]-N,N-dimethylpiperidin-3-amine
CID 107505847
1-methoxy-N-propyl-3-(4-propylpiperidin-1-yl)propan-2-amine
CID 107505652
N,N-diethyl-1-[2-(ethylamino)pentyl]pyrrolidin-3-amine
CID 55160900
1-[2-cyclopentyl-2-(propylamino)ethyl]-N,N-diethylpyrrolidin-3-amine
CID 104746159
1-N-cyclopentyl-1-N-ethyl-3-methoxy-2-N-propylpropane-1,2-diamine
CID 107505386
1-(4-cyclopentylpiperazin-1-yl)-3-methoxy-N-propylpropan-2-amine
CID 107505660
N,N-diethyl-1-[3-(propylamino)butyl]pyrrolidin-3-amine
CID 63169385
1-[3-(methoxymethyl)pyrrolidin-1-yl]-N-propylpentan-2-amine
CID 64569510
1-(2,2-dimethoxyethyl)-N,N-diethylpyrrolidin-3-amine
CID 66223207
N-ethyl-1-methoxy-3-(3-propan-2-ylpyrrolidin-1-yl)propan-2-amine
CID 107505935
N,N-dimethyl-1-[2-(propylamino)pentyl]piperidin-4-amine
CID 62043146
N,N-diethyl-1-[1-methoxy-3-(propylamino)propan-2-yl]pyrrolidin-3-amine
CID 103226506

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1-[3-methoxy-2-(propylamino)propyl]pyrrolidin-3-amine?
The IUPAC name of N,N-diethyl-1-[3-methoxy-2-(propylamino)propyl]pyrrolidin-3-amine (CID 107505722) is N,N-diethyl-1-[3-methoxy-2-(propylamino)propyl]pyrrolidin-3-amine.
What is the SMILES notation for N,N-diethyl-1-[3-methoxy-2-(propylamino)propyl]pyrrolidin-3-amine?
The canonical SMILES for N,N-diethyl-1-[3-methoxy-2-(propylamino)propyl]pyrrolidin-3-amine is CCCNC(COC)CN1CCC(N(CC)CC)C1.
What is the InChIKey of N,N-diethyl-1-[3-methoxy-2-(propylamino)propyl]pyrrolidin-3-amine?
The InChIKey is UJJVVBGWUIHVFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33N3O/c1-5-9-16-14(13-19-4)11-17-10-8-15(12-17)18(6-2)7-3/h14-16H,5-13H2,1-4H3.
What are the key properties of N,N-diethyl-1-[3-methoxy-2-(propylamino)propyl]pyrrolidin-3-amine?
N,N-diethyl-1-[3-methoxy-2-(propylamino)propyl]pyrrolidin-3-amine has a molecular weight of 271.45 g/mol, XLogP of 1.42, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-[3-methoxy-2-(propylamino)propyl]pyrrolidin-3-amine is sourced from PubChem (CID 107505722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).