1-[1-[3-(oxolan-2-yl)propyl]pyrrolidin-3-yl]piperidin-4-amine

C16H31N3O — CID 80553923

IUPAC1-[1-[3-(oxolan-2-yl)propyl]pyrrolidin-3-yl]piperidin-4-amine
SMILESNC1CCN(C2CCN(CCCC3CCCO3)C2)CC1
InChIInChI=1S/C16H31N3O/c17-14-5-10-19(11-6-14)15-7-9-18(13-15)8-1-3-16-4-2-12-20-16/h14-16H,1-13,17H2
InChIKeyYQWWZWCBVMQOSE-UHFFFAOYSA-N
MW281.44 g/mol
LogP1.44
Rot. Bonds5

About 1-[1-[3-(oxolan-2-yl)propyl]pyrrolidin-3-yl]piperidin-4-amine

1-[1-[3-(oxolan-2-yl)propyl]pyrrolidin-3-yl]piperidin-4-amine (PubChem CID 80553923) has the molecular formula C16H31N3O and a molecular weight of 281.44 g/mol. Its IUPAC name is 1-[1-[3-(oxolan-2-yl)propyl]pyrrolidin-3-yl]piperidin-4-amine.

Molecular Properties

Compound Name1-[1-[3-(oxolan-2-yl)propyl]pyrrolidin-3-yl]piperidin-4-amine
PubChem CID80553923
Molecular FormulaC16H31N3O
Molecular Weight281.44 g/mol
Exact Mass281.25
IUPAC Name1-[1-[3-(oxolan-2-yl)propyl]pyrrolidin-3-yl]piperidin-4-amine
SMILESNC1CCN(C2CCN(CCCC3CCCO3)C2)CC1
InChIInChI=1S/C16H31N3O/c17-14-5-10-19(11-6-14)15-7-9-18(13-15)8-1-3-16-4-2-12-20-16/h14-16H,1-13,17H2
InChIKeyYQWWZWCBVMQOSE-UHFFFAOYSA-N
XLogP1.44
TPSA41.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[1-[3-(oxolan-2-yl)propyl]pyrrolidin-3-yl]piperidin-4-amine 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

(3S)-1-[3-(oxolan-2-yl)propyl]pyrrolidin-3-amine
CID 115302471
1-[3-(oxolan-2-yl)propyl]piperidin-4-amine
CID 65159918
[1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]methanamine
CID 65158902
1-(1-octylpyrrolidin-3-yl)piperidin-4-amine
CID 80553977
[1-[3-(oxolan-2-yl)propyl]piperidin-3-yl]methanol
CID 65166006
1-[1-(3-methoxypropyl)pyrrolidin-3-yl]piperidin-4-amine
CID 80552987
1-[2-(3-piperidin-1-ylpyrrolidin-1-yl)ethyl]piperidin-4-amine
CID 79328370
3-(2-chloroethyl)-1-[3-(oxolan-2-yl)propyl]piperidine
CID 65165279
5-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]pentanenitrile
CID 80553177
(3R,4S)-1-[3-(oxolan-2-yl)propyl]pyrrolidine-3,4-diol
CID 79410973
1-[1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]pyrazol-3-amine
CID 107109665
8-[3-(oxolan-2-yl)propyl]-8-azabicyclo[3.2.1]octan-3-amine
CID 65161841

Frequently Asked Questions

What is the IUPAC name of 1-[1-[3-(oxolan-2-yl)propyl]pyrrolidin-3-yl]piperidin-4-amine?
The IUPAC name of 1-[1-[3-(oxolan-2-yl)propyl]pyrrolidin-3-yl]piperidin-4-amine (CID 80553923) is 1-[1-[3-(oxolan-2-yl)propyl]pyrrolidin-3-yl]piperidin-4-amine.
What is the SMILES notation for 1-[1-[3-(oxolan-2-yl)propyl]pyrrolidin-3-yl]piperidin-4-amine?
The canonical SMILES for 1-[1-[3-(oxolan-2-yl)propyl]pyrrolidin-3-yl]piperidin-4-amine is NC1CCN(C2CCN(CCCC3CCCO3)C2)CC1.
What is the InChIKey of 1-[1-[3-(oxolan-2-yl)propyl]pyrrolidin-3-yl]piperidin-4-amine?
The InChIKey is YQWWZWCBVMQOSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O/c17-14-5-10-19(11-6-14)15-7-9-18(13-15)8-1-3-16-4-2-12-20-16/h14-16H,1-13,17H2.
What are the key properties of 1-[1-[3-(oxolan-2-yl)propyl]pyrrolidin-3-yl]piperidin-4-amine?
1-[1-[3-(oxolan-2-yl)propyl]pyrrolidin-3-yl]piperidin-4-amine has a molecular weight of 281.44 g/mol, XLogP of 1.44, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[3-(oxolan-2-yl)propyl]pyrrolidin-3-yl]piperidin-4-amine is sourced from PubChem (CID 80553923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).