4-(2-methoxyphenyl)-N-(1-pyridin-4-ylethenyl)piperazin-1-amine

C18H22N4O — CID 4623778

IUPAC4-(2-methoxyphenyl)-N-(1-pyridin-4-ylethenyl)piperazin-1-amine
SMILESC=C(NN1CCN(c2ccccc2OC)CC1)c1ccncc1
InChIInChI=1S/C18H22N4O/c1-15(16-7-9-19-10-8-16)20-22-13-11-21(12-14-22)17-5-3-4-6-18(17)23-2/h3-10,20H,1,11-14H2,2H3
InChIKeyGNGQQHLPGREORW-UHFFFAOYSA-N
MW310.40 g/mol
LogP2.39
Rot. Bonds5

About 4-(2-methoxyphenyl)-N-(1-pyridin-4-ylethenyl)piperazin-1-amine

4-(2-methoxyphenyl)-N-(1-pyridin-4-ylethenyl)piperazin-1-amine (PubChem CID 4623778) has the molecular formula C18H22N4O and a molecular weight of 310.40 g/mol. Its IUPAC name is 4-(2-methoxyphenyl)-N-(1-pyridin-4-ylethenyl)piperazin-1-amine.

Molecular Properties

Compound Name4-(2-methoxyphenyl)-N-(1-pyridin-4-ylethenyl)piperazin-1-amine
PubChem CID4623778
Molecular FormulaC18H22N4O
Molecular Weight310.40 g/mol
Exact Mass310.18
IUPAC Name4-(2-methoxyphenyl)-N-(1-pyridin-4-ylethenyl)piperazin-1-amine
SMILESC=C(NN1CCN(c2ccccc2OC)CC1)c1ccncc1
InChIInChI=1S/C18H22N4O/c1-15(16-7-9-19-10-8-16)20-22-13-11-21(12-14-22)17-5-3-4-6-18(17)23-2/h3-10,20H,1,11-14H2,2H3
InChIKeyGNGQQHLPGREORW-UHFFFAOYSA-N
XLogP2.39
TPSA40.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2-methoxyphenyl)-N-prop-1-en-2-ylpiperazine-1-carboxamide
CID 108910374
1-ethynyl-4-(2-methoxyphenyl)piperazine
CID 67760707
4-(2-methoxyphenyl)-N-pyrazin-2-ylpiperazine-1-carboxamide
CID 110492522
16-(2-methoxyphenyl)-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
CID 86134682
N-[2-(4-chlorophenyl)-3-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-5-methylpyrrol-1-yl]pyridine-4-carboxamide
CID 10481649
(5-hydroxy-3-pyridinyl)-[4-(2-methoxyphenyl)piperazin-1-yl]methanone
CID 110854337
1-(2-methoxyphenyl)-4-nitrosopiperazine
CID 154814146
1-(chloromethyl)-4-(2-methoxyphenyl)piperazine
CID 19434771
[2-[4-(2-methoxyphenyl)piperazin-1-yl]pyrimidin-5-yl]-pyrrolidin-1-ylmethanone
CID 109249260
2-[4-(2-hydroxy-6-methoxybenzoyl)piperazin-1-yl]benzonitrile
CID 126828908
2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanol;dihydrochloride
CID 71671571
CID 19104384
CID 19104384

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyphenyl)-N-(1-pyridin-4-ylethenyl)piperazin-1-amine?
The IUPAC name of 4-(2-methoxyphenyl)-N-(1-pyridin-4-ylethenyl)piperazin-1-amine (CID 4623778) is 4-(2-methoxyphenyl)-N-(1-pyridin-4-ylethenyl)piperazin-1-amine.
What is the SMILES notation for 4-(2-methoxyphenyl)-N-(1-pyridin-4-ylethenyl)piperazin-1-amine?
The canonical SMILES for 4-(2-methoxyphenyl)-N-(1-pyridin-4-ylethenyl)piperazin-1-amine is C=C(NN1CCN(c2ccccc2OC)CC1)c1ccncc1.
What is the InChIKey of 4-(2-methoxyphenyl)-N-(1-pyridin-4-ylethenyl)piperazin-1-amine?
The InChIKey is GNGQQHLPGREORW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O/c1-15(16-7-9-19-10-8-16)20-22-13-11-21(12-14-22)17-5-3-4-6-18(17)23-2/h3-10,20H,1,11-14H2,2H3.
What are the key properties of 4-(2-methoxyphenyl)-N-(1-pyridin-4-ylethenyl)piperazin-1-amine?
4-(2-methoxyphenyl)-N-(1-pyridin-4-ylethenyl)piperazin-1-amine has a molecular weight of 310.40 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyphenyl)-N-(1-pyridin-4-ylethenyl)piperazin-1-amine is sourced from PubChem (CID 4623778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).