2-[2-[cyclopropyl(methyl)amino]ethoxy]-6-propoxyaniline

C15H24N2O2 — CID 102739820

IUPAC2-[2-[cyclopropyl(methyl)amino]ethoxy]-6-propoxyaniline
SMILESCCCOc1cccc(OCCN(C)C2CC2)c1N
InChIInChI=1S/C15H24N2O2/c1-3-10-18-13-5-4-6-14(15(13)16)19-11-9-17(2)12-7-8-12/h4-6,12H,3,7-11,16H2,1-2H3
InChIKeyOPZGQSWHXIFSEX-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.53
Rot. Bonds8

About 2-[2-[cyclopropyl(methyl)amino]ethoxy]-6-propoxyaniline

2-[2-[cyclopropyl(methyl)amino]ethoxy]-6-propoxyaniline (PubChem CID 102739820) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-[2-[cyclopropyl(methyl)amino]ethoxy]-6-propoxyaniline.

Molecular Properties

Compound Name2-[2-[cyclopropyl(methyl)amino]ethoxy]-6-propoxyaniline
PubChem CID102739820
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-[2-[cyclopropyl(methyl)amino]ethoxy]-6-propoxyaniline
SMILESCCCOc1cccc(OCCN(C)C2CC2)c1N
InChIInChI=1S/C15H24N2O2/c1-3-10-18-13-5-4-6-14(15(13)16)19-11-9-17(2)12-7-8-12/h4-6,12H,3,7-11,16H2,1-2H3
InChIKeyOPZGQSWHXIFSEX-UHFFFAOYSA-N
XLogP2.53
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(2-cyclobutylethoxy)-6-propoxyaniline
CID 106199742
4-N-methyl-4-N-[2-(2-methylphenoxy)ethyl]cyclohexane-1,4-diamine
CID 79121489
2-[2-[cyclopropyl(methyl)amino]ethoxy]-5-fluoroaniline
CID 102739824
1-N-methyl-3-propoxy-1-N-(thiolan-3-yl)benzene-1,2-diamine
CID 113393306
4-[2-[cyclopropyl(methyl)amino]ethoxy]-3-iodoaniline
CID 102739775
N-methyl-N-[2-[2-[1-(propylamino)propyl]phenoxy]ethyl]cyclopropanamine
CID 102740250
ethyl 3-amino-2-[2-[cyclopropyl(methyl)amino]ethoxy]benzoate
CID 102740371
2-[2-[cyclopropyl(methyl)amino]ethoxy]-6-ethylsulfanylbenzoic acid
CID 102741142
2-[2-[cyclopropyl(methyl)amino]ethoxy]-4-ethoxy-5-fluoroaniline
CID 102739879
2-bromo-6-[2-[cyclopropyl(methyl)amino]ethoxy]benzoic acid
CID 102741107
N-[2-[3-methoxy-2-[1-(methylamino)ethyl]phenoxy]ethyl]-N-methylcyclopropanamine
CID 102740278
N-[2-[4-(aminomethyl)phenoxy]ethyl]-N-methylcyclopropanamine
CID 43264634

Frequently Asked Questions

What is the IUPAC name of 2-[2-[cyclopropyl(methyl)amino]ethoxy]-6-propoxyaniline?
The IUPAC name of 2-[2-[cyclopropyl(methyl)amino]ethoxy]-6-propoxyaniline (CID 102739820) is 2-[2-[cyclopropyl(methyl)amino]ethoxy]-6-propoxyaniline.
What is the SMILES notation for 2-[2-[cyclopropyl(methyl)amino]ethoxy]-6-propoxyaniline?
The canonical SMILES for 2-[2-[cyclopropyl(methyl)amino]ethoxy]-6-propoxyaniline is CCCOc1cccc(OCCN(C)C2CC2)c1N.
What is the InChIKey of 2-[2-[cyclopropyl(methyl)amino]ethoxy]-6-propoxyaniline?
The InChIKey is OPZGQSWHXIFSEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-3-10-18-13-5-4-6-14(15(13)16)19-11-9-17(2)12-7-8-12/h4-6,12H,3,7-11,16H2,1-2H3.
What are the key properties of 2-[2-[cyclopropyl(methyl)amino]ethoxy]-6-propoxyaniline?
2-[2-[cyclopropyl(methyl)amino]ethoxy]-6-propoxyaniline has a molecular weight of 264.37 g/mol, XLogP of 2.53, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[cyclopropyl(methyl)amino]ethoxy]-6-propoxyaniline is sourced from PubChem (CID 102739820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).