1-(4-cyclopropyloxyphenyl)-N-ethyl-2-pyridin-4-ylethanamine

C18H22N2O — CID 114519365

IUPAC1-(4-cyclopropyloxyphenyl)-N-ethyl-2-pyridin-4-ylethanamine
SMILESCCNC(Cc1ccncc1)c1ccc(OC2CC2)cc1
InChIInChI=1S/C18H22N2O/c1-2-20-18(13-14-9-11-19-12-10-14)15-3-5-16(6-4-15)21-17-7-8-17/h3-6,9-12,17-18,20H,2,7-8,13H2,1H3
InChIKeyMGSOGHSWBHEVSH-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.52
Rot. Bonds7

About 1-(4-cyclopropyloxyphenyl)-N-ethyl-2-pyridin-4-ylethanamine

1-(4-cyclopropyloxyphenyl)-N-ethyl-2-pyridin-4-ylethanamine (PubChem CID 114519365) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is 1-(4-cyclopropyloxyphenyl)-N-ethyl-2-pyridin-4-ylethanamine.

Molecular Properties

Compound Name1-(4-cyclopropyloxyphenyl)-N-ethyl-2-pyridin-4-ylethanamine
PubChem CID114519365
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC Name1-(4-cyclopropyloxyphenyl)-N-ethyl-2-pyridin-4-ylethanamine
SMILESCCNC(Cc1ccncc1)c1ccc(OC2CC2)cc1
InChIInChI=1S/C18H22N2O/c1-2-20-18(13-14-9-11-19-12-10-14)15-3-5-16(6-4-15)21-17-7-8-17/h3-6,9-12,17-18,20H,2,7-8,13H2,1H3
InChIKeyMGSOGHSWBHEVSH-UHFFFAOYSA-N
XLogP3.52
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-cyclopropyloxyphenyl)-N-ethyl-2-pyridin-4-ylethanamine
CID 114521652
1-(4-cyclopropyloxyphenyl)-N-ethyl-3-methylpentan-1-amine
CID 105051444
1-(4-cyclopropyloxyphenyl)-N,N',N'-triethylpropane-1,3-diamine
CID 114519577
N-[(4-cyclopropyloxyphenyl)-pyrimidin-4-ylmethyl]ethanamine
CID 114519422
1-(4-cyclopropyloxyphenyl)-N-ethyl-2-(oxolan-2-yl)ethanamine
CID 114519253
N-[cyclopropyl-(4-cyclopropyloxyphenyl)methyl]ethanamine
CID 114519282
1-cyclopropyl-N-ethyl-2-pyridin-4-ylethanamine
CID 63355352
[1-(4-cyclopropyloxyphenyl)-2-pyridin-3-ylethyl]hydrazine
CID 105212080
N-[(3-cyclopropyloxyphenyl)-pyridin-4-ylmethyl]ethanamine
CID 114521537
(1S)-1-(4-cyclopentyloxyphenyl)-N-ethylethanamine
CID 93007263
N-[(4-cyclopropyloxyphenyl)-thiophen-2-ylmethyl]ethanamine
CID 114519196
2-cyclopropyl-N-ethyl-1-pyridin-4-ylethanamine
CID 64906307

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclopropyloxyphenyl)-N-ethyl-2-pyridin-4-ylethanamine?
The IUPAC name of 1-(4-cyclopropyloxyphenyl)-N-ethyl-2-pyridin-4-ylethanamine (CID 114519365) is 1-(4-cyclopropyloxyphenyl)-N-ethyl-2-pyridin-4-ylethanamine.
What is the SMILES notation for 1-(4-cyclopropyloxyphenyl)-N-ethyl-2-pyridin-4-ylethanamine?
The canonical SMILES for 1-(4-cyclopropyloxyphenyl)-N-ethyl-2-pyridin-4-ylethanamine is CCNC(Cc1ccncc1)c1ccc(OC2CC2)cc1.
What is the InChIKey of 1-(4-cyclopropyloxyphenyl)-N-ethyl-2-pyridin-4-ylethanamine?
The InChIKey is MGSOGHSWBHEVSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c1-2-20-18(13-14-9-11-19-12-10-14)15-3-5-16(6-4-15)21-17-7-8-17/h3-6,9-12,17-18,20H,2,7-8,13H2,1H3.
What are the key properties of 1-(4-cyclopropyloxyphenyl)-N-ethyl-2-pyridin-4-ylethanamine?
1-(4-cyclopropyloxyphenyl)-N-ethyl-2-pyridin-4-ylethanamine has a molecular weight of 282.39 g/mol, XLogP of 3.52, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclopropyloxyphenyl)-N-ethyl-2-pyridin-4-ylethanamine is sourced from PubChem (CID 114519365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).