1-(4-ethoxyphenyl)ethenamine

C10H13NO — CID 129289710

IUPAC1-(4-ethoxyphenyl)ethenamine
SMILESC=C(N)c1ccc(OCC)cc1
InChIInChI=1S/C10H13NO/c1-3-12-10-6-4-9(5-7-10)8(2)11/h4-7H,2-3,11H2,1H3
InChIKeyPNGKZAUOYFGWOR-UHFFFAOYSA-N
MW163.22 g/mol
LogP2.01
Rot. Bonds3

About 1-(4-ethoxyphenyl)ethenamine

1-(4-ethoxyphenyl)ethenamine (PubChem CID 129289710) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is 1-(4-ethoxyphenyl)ethenamine.

Molecular Properties

Compound Name1-(4-ethoxyphenyl)ethenamine
PubChem CID129289710
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name1-(4-ethoxyphenyl)ethenamine
SMILESC=C(N)c1ccc(OCC)cc1
InChIInChI=1S/C10H13NO/c1-3-12-10-6-4-9(5-7-10)8(2)11/h4-7H,2-3,11H2,1H3
InChIKeyPNGKZAUOYFGWOR-UHFFFAOYSA-N
XLogP2.01
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-but-1-en-2-yl-4-ethoxybenzene
CID 129179740
4-(4-ethoxyphenyl)benzamide
CID 163572533
1-(4-ethoxyphenyl)ethylidenehydrazine
CID 937394
1-but-1-en-2-yl-4-ethoxybenzene;prop-1-yne
CID 143958976
ethane;(3Z)-4-(4-ethoxyphenyl)buta-1,3-diene-1,1,4-triamine
CID 178030226
4-(4-ethoxyphenoxy)-N'-hydroxybenzenecarboximidamide
CID 43188257
1-ethoxy-4-(3-hydroperoxy-3-methylbut-1-en-2-yl)benzene
CID 24971485
benzamide;1,4-diethoxybenzene
CID 162120306
(3,4-dimethoxyphenyl)-(4-ethoxyphenyl)methanone
CID 14297393
S-(4-ethoxyphenyl)thiohydroxylamine
CID 117033765
1-(4-ethoxyphenyl)-2-(4-prop-2-enoxyphenyl)ethane-1,2-dione
CID 129074944
(NZ)-N-[1-(4-ethoxyphenyl)ethylidene]hydroxylamine
CID 6161397

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethoxyphenyl)ethenamine?
The IUPAC name of 1-(4-ethoxyphenyl)ethenamine (CID 129289710) is 1-(4-ethoxyphenyl)ethenamine.
What is the SMILES notation for 1-(4-ethoxyphenyl)ethenamine?
The canonical SMILES for 1-(4-ethoxyphenyl)ethenamine is C=C(N)c1ccc(OCC)cc1.
What is the InChIKey of 1-(4-ethoxyphenyl)ethenamine?
The InChIKey is PNGKZAUOYFGWOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO/c1-3-12-10-6-4-9(5-7-10)8(2)11/h4-7H,2-3,11H2,1H3.
What are the key properties of 1-(4-ethoxyphenyl)ethenamine?
1-(4-ethoxyphenyl)ethenamine has a molecular weight of 163.22 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethoxyphenyl)ethenamine is sourced from PubChem (CID 129289710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).