N-[2-(furan-2-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine

C13H22N2O — CID 79540382

IUPACN-[2-(furan-2-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine
SMILESCC(CC1CCCN1)NCCc1ccco1
InChIInChI=1S/C13H22N2O/c1-11(10-12-4-2-7-15-12)14-8-6-13-5-3-9-16-13/h3,5,9,11-12,14-15H,2,4,6-8,10H2,1H3
InChIKeyYVHWODRUGISOHM-UHFFFAOYSA-N
MW222.33 g/mol
LogP1.94
Rot. Bonds6

About N-[2-(furan-2-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine

N-[2-(furan-2-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine (PubChem CID 79540382) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is N-[2-(furan-2-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-[2-(furan-2-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine
PubChem CID79540382
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC NameN-[2-(furan-2-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine
SMILESCC(CC1CCCN1)NCCc1ccco1
InChIInChI=1S/C13H22N2O/c1-11(10-12-4-2-7-15-12)14-8-6-13-5-3-9-16-13/h3,5,9,11-12,14-15H,2,4,6-8,10H2,1H3
InChIKeyYVHWODRUGISOHM-UHFFFAOYSA-N
XLogP1.94
TPSA37.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[2-(furan-2-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-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

1-(azepan-2-yl)-N-[3-(furan-2-ylmethoxy)propyl]propan-2-amine
CID 79541309
1-(azepan-2-yl)-N-[2-(4-fluorophenyl)ethyl]propan-2-amine
CID 79553439
4-[2-(1-piperidin-2-ylpropan-2-ylamino)ethyl]phenol
CID 79536773
N-[1-(furan-2-yl)ethyl]-1-piperidin-2-ylpropan-2-amine
CID 79549697
N-[2-(4-nitrophenyl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine
CID 79540548
1-(azepan-2-yl)-N-[1-(furan-2-yl)ethyl]propan-2-amine
CID 79560545
N'-(1-pyrrolidin-2-ylpropan-2-yl)ethane-1,2-diamine
CID 79540795
2-(furan-2-yl)-N-[(3-methylpiperidin-2-yl)methyl]ethanamine
CID 107069094
4-methyl-N-(1-pyrrolidin-2-ylpropan-2-yl)pentan-1-amine
CID 79540929
N-(2-phenylsulfanylethyl)-1-piperidin-2-ylpropan-2-amine
CID 79537019
(1R)-1-(furan-2-yl)-2-[(2S)-pyrrolidin-2-yl]ethanol
CID 95975648
N-(2-cyclohexylethyl)-1-pyrrolidin-2-ylpropan-2-amine
CID 79541429

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine?
The IUPAC name of N-[2-(furan-2-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine (CID 79540382) is N-[2-(furan-2-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine.
What is the SMILES notation for N-[2-(furan-2-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine?
The canonical SMILES for N-[2-(furan-2-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine is CC(CC1CCCN1)NCCc1ccco1.
What is the InChIKey of N-[2-(furan-2-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine?
The InChIKey is YVHWODRUGISOHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O/c1-11(10-12-4-2-7-15-12)14-8-6-13-5-3-9-16-13/h3,5,9,11-12,14-15H,2,4,6-8,10H2,1H3.
What are the key properties of N-[2-(furan-2-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine?
N-[2-(furan-2-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine has a molecular weight of 222.33 g/mol, XLogP of 1.94, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine is sourced from PubChem (CID 79540382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).