2-(2,5-dimethoxy-4-pyrrolidin-1-ylphenyl)-N-methylethanamine

C15H24N2O2 — CID 117415704

IUPAC2-(2,5-dimethoxy-4-pyrrolidin-1-ylphenyl)-N-methylethanamine
SMILESCNCCc1cc(OC)c(N2CCCC2)cc1OC
InChIInChI=1S/C15H24N2O2/c1-16-7-6-12-10-15(19-3)13(11-14(12)18-2)17-8-4-5-9-17/h10-11,16H,4-9H2,1-3H3
InChIKeyOIBXIAYWSBYVFU-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.07
Rot. Bonds6

About 2-(2,5-dimethoxy-4-pyrrolidin-1-ylphenyl)-N-methylethanamine

2-(2,5-dimethoxy-4-pyrrolidin-1-ylphenyl)-N-methylethanamine (PubChem CID 117415704) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-(2,5-dimethoxy-4-pyrrolidin-1-ylphenyl)-N-methylethanamine.

Molecular Properties

Compound Name2-(2,5-dimethoxy-4-pyrrolidin-1-ylphenyl)-N-methylethanamine
PubChem CID117415704
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-(2,5-dimethoxy-4-pyrrolidin-1-ylphenyl)-N-methylethanamine
SMILESCNCCc1cc(OC)c(N2CCCC2)cc1OC
InChIInChI=1S/C15H24N2O2/c1-16-7-6-12-10-15(19-3)13(11-14(12)18-2)17-8-4-5-9-17/h10-11,16H,4-9H2,1-3H3
InChIKeyOIBXIAYWSBYVFU-UHFFFAOYSA-N
XLogP2.07
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,5-dimethoxy-4-pyrrolidin-1-ylphenyl)ethanol
CID 117381555
3-(2,5-dimethoxy-4-piperidin-1-ylphenyl)propan-1-amine
CID 117446608
1-(2,5-dimethoxy-4-pyrrolidin-1-ylphenyl)-N-methoxymethanamine
CID 117420098
4-(2,5-dimethoxy-4-piperidin-1-ylphenyl)butanoic acid
CID 117492352
1-(2,5-dimethoxy-4-piperidin-1-ylphenyl)-2-(methylamino)ethanone
CID 117472207
2-[4-(difluoromethyl)-2,5-dimethoxyphenyl]-N-methylethanamine
CID 117364649
2-(4-imidazolidin-1-yl-2,5-dimethoxyphenyl)ethanamine
CID 171534506
2-[2,5-dimethoxy-4-(1,3-thiazolidin-3-yl)phenyl]ethanamine
CID 171534609
4,5-dimethoxy-2-[2-(methylamino)ethyl]aniline
CID 22439028
2-(5-fluoro-2-methoxy-4-methylphenyl)-N-methylethanamine
CID 84667680
2-(2,4-dichloro-5-methoxyphenyl)-N-methylethanamine
CID 83895894
4,5-dimethoxy-2-piperidin-1-ylaniline
CID 616846

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethoxy-4-pyrrolidin-1-ylphenyl)-N-methylethanamine?
The IUPAC name of 2-(2,5-dimethoxy-4-pyrrolidin-1-ylphenyl)-N-methylethanamine (CID 117415704) is 2-(2,5-dimethoxy-4-pyrrolidin-1-ylphenyl)-N-methylethanamine.
What is the SMILES notation for 2-(2,5-dimethoxy-4-pyrrolidin-1-ylphenyl)-N-methylethanamine?
The canonical SMILES for 2-(2,5-dimethoxy-4-pyrrolidin-1-ylphenyl)-N-methylethanamine is CNCCc1cc(OC)c(N2CCCC2)cc1OC.
What is the InChIKey of 2-(2,5-dimethoxy-4-pyrrolidin-1-ylphenyl)-N-methylethanamine?
The InChIKey is OIBXIAYWSBYVFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-16-7-6-12-10-15(19-3)13(11-14(12)18-2)17-8-4-5-9-17/h10-11,16H,4-9H2,1-3H3.
What are the key properties of 2-(2,5-dimethoxy-4-pyrrolidin-1-ylphenyl)-N-methylethanamine?
2-(2,5-dimethoxy-4-pyrrolidin-1-ylphenyl)-N-methylethanamine has a molecular weight of 264.37 g/mol, XLogP of 2.07, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethoxy-4-pyrrolidin-1-ylphenyl)-N-methylethanamine is sourced from PubChem (CID 117415704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).