5-methoxy-4-N-[1-(4-methoxyphenyl)ethyl]pentane-1,4-diamine

C15H26N2O2 — CID 103390275

IUPAC5-methoxy-4-N-[1-(4-methoxyphenyl)ethyl]pentane-1,4-diamine
SMILESCOCC(CCCN)NC(C)c1ccc(OC)cc1
InChIInChI=1S/C15H26N2O2/c1-12(13-6-8-15(19-3)9-7-13)17-14(11-18-2)5-4-10-16/h6-9,12,14,17H,4-5,10-11,16H2,1-3H3
InChIKeyJRTPEJLMMUBDLI-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.10
Rot. Bonds9

About 5-methoxy-4-N-[1-(4-methoxyphenyl)ethyl]pentane-1,4-diamine

5-methoxy-4-N-[1-(4-methoxyphenyl)ethyl]pentane-1,4-diamine (PubChem CID 103390275) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 5-methoxy-4-N-[1-(4-methoxyphenyl)ethyl]pentane-1,4-diamine.

Molecular Properties

Compound Name5-methoxy-4-N-[1-(4-methoxyphenyl)ethyl]pentane-1,4-diamine
PubChem CID103390275
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name5-methoxy-4-N-[1-(4-methoxyphenyl)ethyl]pentane-1,4-diamine
SMILESCOCC(CCCN)NC(C)c1ccc(OC)cc1
InChIInChI=1S/C15H26N2O2/c1-12(13-6-8-15(19-3)9-7-13)17-14(11-18-2)5-4-10-16/h6-9,12,14,17H,4-5,10-11,16H2,1-3H3
InChIKeyJRTPEJLMMUBDLI-UHFFFAOYSA-N
XLogP2.10
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-[1-(1,3-benzodioxol-5-yl)ethyl]-5-methoxypentane-1,4-diamine
CID 103388237
5-methoxy-4-N-[(1S)-1-(2-methoxyphenyl)ethyl]pentane-1,4-diamine
CID 103390524
1-(4-methoxyphenyl)-N-[1-(4-methoxyphenyl)ethyl]ethanamine
CID 12644064
5-methoxy-4-N-(2-methyl-1-phenylpropyl)pentane-1,4-diamine
CID 103388167
4-N-[1-(2,4-dimethylphenyl)ethyl]-5-methoxypentane-1,4-diamine
CID 103389173
4-methoxy-3-[1-(4-propoxyphenyl)ethylamino]butan-1-ol
CID 103785549
1-(4-methoxyphenyl)-N-methylbutane-1,4-diamine
CID 116949257
4-[1-[(4-hydroxy-1-methoxybutan-2-yl)amino]ethyl]phenol
CID 114151398
1-cyclopropyl-2-methoxy-N-[(1R)-1-(4-methoxyphenyl)ethyl]ethanamine
CID 81370901
5-methoxy-4-N-(3-methylpentan-2-yl)pentane-1,4-diamine
CID 103389536
5-methoxy-4-N-pentan-2-ylpentane-1,4-diamine
CID 103387026
2-[1-(4-methoxyphenyl)ethylamino]-4-methylpentan-1-ol
CID 61246097

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-4-N-[1-(4-methoxyphenyl)ethyl]pentane-1,4-diamine?
The IUPAC name of 5-methoxy-4-N-[1-(4-methoxyphenyl)ethyl]pentane-1,4-diamine (CID 103390275) is 5-methoxy-4-N-[1-(4-methoxyphenyl)ethyl]pentane-1,4-diamine.
What is the SMILES notation for 5-methoxy-4-N-[1-(4-methoxyphenyl)ethyl]pentane-1,4-diamine?
The canonical SMILES for 5-methoxy-4-N-[1-(4-methoxyphenyl)ethyl]pentane-1,4-diamine is COCC(CCCN)NC(C)c1ccc(OC)cc1.
What is the InChIKey of 5-methoxy-4-N-[1-(4-methoxyphenyl)ethyl]pentane-1,4-diamine?
The InChIKey is JRTPEJLMMUBDLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-12(13-6-8-15(19-3)9-7-13)17-14(11-18-2)5-4-10-16/h6-9,12,14,17H,4-5,10-11,16H2,1-3H3.
What are the key properties of 5-methoxy-4-N-[1-(4-methoxyphenyl)ethyl]pentane-1,4-diamine?
5-methoxy-4-N-[1-(4-methoxyphenyl)ethyl]pentane-1,4-diamine has a molecular weight of 266.38 g/mol, XLogP of 2.10, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-4-N-[1-(4-methoxyphenyl)ethyl]pentane-1,4-diamine is sourced from PubChem (CID 103390275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).