N-[1-(2,5-dimethoxyphenyl)ethyl]-2-propylcyclopropan-1-amine

C16H25NO2 — CID 103902739

IUPACN-[1-(2,5-dimethoxyphenyl)ethyl]-2-propylcyclopropan-1-amine
SMILESCCCC1CC1NC(C)c1cc(OC)ccc1OC
InChIInChI=1S/C16H25NO2/c1-5-6-12-9-15(12)17-11(2)14-10-13(18-3)7-8-16(14)19-4/h7-8,10-12,15,17H,5-6,9H2,1-4H3
InChIKeyLJXWVKPDUXSXNG-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.54
Rot. Bonds7

About N-[1-(2,5-dimethoxyphenyl)ethyl]-2-propylcyclopropan-1-amine

N-[1-(2,5-dimethoxyphenyl)ethyl]-2-propylcyclopropan-1-amine (PubChem CID 103902739) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is N-[1-(2,5-dimethoxyphenyl)ethyl]-2-propylcyclopropan-1-amine.

Molecular Properties

Compound NameN-[1-(2,5-dimethoxyphenyl)ethyl]-2-propylcyclopropan-1-amine
PubChem CID103902739
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC NameN-[1-(2,5-dimethoxyphenyl)ethyl]-2-propylcyclopropan-1-amine
SMILESCCCC1CC1NC(C)c1cc(OC)ccc1OC
InChIInChI=1S/C16H25NO2/c1-5-6-12-9-15(12)17-11(2)14-10-13(18-3)7-8-16(14)19-4/h7-8,10-12,15,17H,5-6,9H2,1-4H3
InChIKeyLJXWVKPDUXSXNG-UHFFFAOYSA-N
XLogP3.54
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-2-propylcyclopropan-1-amine
CID 103902769
N-[1-(2,5-dimethoxyphenyl)ethyl]-2-methylsulfanylcyclopentan-1-amine
CID 103786580
2-ethyl-N-[1-(2-methoxyphenyl)ethyl]cyclopropan-1-amine
CID 103783784
1-(2,5-dimethoxyphenyl)-N-ethoxyethanamine
CID 82709740
N-[1-(7-methoxy-1-benzofuran-2-yl)ethyl]-2-propylcyclopropan-1-amine
CID 103921920
N-[1-(2,5-dimethoxyphenyl)ethyl]pentan-2-amine
CID 43191466
N-[1-(2,5-dimethoxyphenyl)ethyl]-2,3-dihydro-1H-inden-2-amine
CID 119164773
(1S)-1-(2,5-dimethoxyphenyl)-N-methylethanamine
CID 40516621
4-fluoro-2-[1-[(2-propylcyclopropyl)amino]ethyl]phenol
CID 104583308
N-[1-(2,5-dimethoxyphenyl)ethyl]-1,5-dimethylpyrrolidin-3-amine
CID 81301022
1-N-[1-(2,5-dimethoxyphenyl)ethyl]cyclohexane-1,3-diamine
CID 79459133
N-[1-(2,4-dimethoxyphenyl)ethyl]-3-ethyl-2-methylcyclopentan-1-amine
CID 64920557

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,5-dimethoxyphenyl)ethyl]-2-propylcyclopropan-1-amine?
The IUPAC name of N-[1-(2,5-dimethoxyphenyl)ethyl]-2-propylcyclopropan-1-amine (CID 103902739) is N-[1-(2,5-dimethoxyphenyl)ethyl]-2-propylcyclopropan-1-amine.
What is the SMILES notation for N-[1-(2,5-dimethoxyphenyl)ethyl]-2-propylcyclopropan-1-amine?
The canonical SMILES for N-[1-(2,5-dimethoxyphenyl)ethyl]-2-propylcyclopropan-1-amine is CCCC1CC1NC(C)c1cc(OC)ccc1OC.
What is the InChIKey of N-[1-(2,5-dimethoxyphenyl)ethyl]-2-propylcyclopropan-1-amine?
The InChIKey is LJXWVKPDUXSXNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-5-6-12-9-15(12)17-11(2)14-10-13(18-3)7-8-16(14)19-4/h7-8,10-12,15,17H,5-6,9H2,1-4H3.
What are the key properties of N-[1-(2,5-dimethoxyphenyl)ethyl]-2-propylcyclopropan-1-amine?
N-[1-(2,5-dimethoxyphenyl)ethyl]-2-propylcyclopropan-1-amine has a molecular weight of 263.38 g/mol, XLogP of 3.54, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,5-dimethoxyphenyl)ethyl]-2-propylcyclopropan-1-amine is sourced from PubChem (CID 103902739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).