1-[2-(5-ethyl-2-pyridinyl)ethyl]-4-(2-methoxyphenyl)piperazine

C20H27N3O — CID 71430224

IUPAC1-[2-(5-ethyl-2-pyridinyl)ethyl]-4-(2-methoxyphenyl)piperazine
SMILESCCc1ccc(CCN2CCN(c3ccccc3OC)CC2)nc1
InChIInChI=1S/C20H27N3O/c1-3-17-8-9-18(21-16-17)10-11-22-12-14-23(15-13-22)19-6-4-5-7-20(19)24-2/h4-9,16H,3,10-15H2,1-2H3
InChIKeyGJBZRMPBLLNQKT-UHFFFAOYSA-N
MW325.46 g/mol
LogP3.02
Rot. Bonds6

About 1-[2-(5-ethyl-2-pyridinyl)ethyl]-4-(2-methoxyphenyl)piperazine

1-[2-(5-ethyl-2-pyridinyl)ethyl]-4-(2-methoxyphenyl)piperazine (PubChem CID 71430224) has the molecular formula C20H27N3O and a molecular weight of 325.46 g/mol. Its IUPAC name is 1-[2-(5-ethyl-2-pyridinyl)ethyl]-4-(2-methoxyphenyl)piperazine.

Molecular Properties

Compound Name1-[2-(5-ethyl-2-pyridinyl)ethyl]-4-(2-methoxyphenyl)piperazine
PubChem CID71430224
Molecular FormulaC20H27N3O
Molecular Weight325.46 g/mol
Exact Mass325.22
IUPAC Name1-[2-(5-ethyl-2-pyridinyl)ethyl]-4-(2-methoxyphenyl)piperazine
SMILESCCc1ccc(CCN2CCN(c3ccccc3OC)CC2)nc1
InChIInChI=1S/C20H27N3O/c1-3-17-8-9-18(21-16-17)10-11-22-12-14-23(15-13-22)19-6-4-5-7-20(19)24-2/h4-9,16H,3,10-15H2,1-2H3
InChIKeyGJBZRMPBLLNQKT-UHFFFAOYSA-N
XLogP3.02
TPSA28.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.46
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-methoxyphenyl)-4-[2-(2H-triazol-4-yl)ethyl]piperazine;hydrochloride
CID 142648010
1-[2-[4-[(3,5-dimethoxyphenoxy)methyl]phenyl]ethyl]-4-(2-methoxyphenyl)piperazine
CID 118720221
[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]methanamine
CID 139749924
2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanol;dihydrochloride
CID 71671571
1-(2-methoxyphenyl)-4-[2-[3-[3-[3-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]phenoxy]propoxy]phenyl]ethyl]piperazine
CID 23661594
N-(4-ethylphenyl)-3-[4-(2-methoxyphenyl)piperazin-1-yl]propanamide
CID 109029533
1-(2-methoxyphenyl)-4-[2-[4-methoxy-3-(2-phenylethoxy)phenyl]ethyl]piperazine;dihydrochloride
CID 18986838
1-(2-methoxyphenyl)-4-[2-(triazol-2-yl)ethyl]piperazine
CID 155941923
3-[4-(2-methoxyphenyl)piperazin-1-yl]propan-1-amine
CID 10467259
6-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-3H-1,3-benzothiazol-2-one
CID 10547091
2-[2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]phenyl]acetic acid
CID 174365848
1-(chloromethyl)-4-(2-methoxyphenyl)piperazine
CID 19434771

Frequently Asked Questions

What is the IUPAC name of 1-[2-(5-ethyl-2-pyridinyl)ethyl]-4-(2-methoxyphenyl)piperazine?
The IUPAC name of 1-[2-(5-ethyl-2-pyridinyl)ethyl]-4-(2-methoxyphenyl)piperazine (CID 71430224) is 1-[2-(5-ethyl-2-pyridinyl)ethyl]-4-(2-methoxyphenyl)piperazine.
What is the SMILES notation for 1-[2-(5-ethyl-2-pyridinyl)ethyl]-4-(2-methoxyphenyl)piperazine?
The canonical SMILES for 1-[2-(5-ethyl-2-pyridinyl)ethyl]-4-(2-methoxyphenyl)piperazine is CCc1ccc(CCN2CCN(c3ccccc3OC)CC2)nc1.
What is the InChIKey of 1-[2-(5-ethyl-2-pyridinyl)ethyl]-4-(2-methoxyphenyl)piperazine?
The InChIKey is GJBZRMPBLLNQKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O/c1-3-17-8-9-18(21-16-17)10-11-22-12-14-23(15-13-22)19-6-4-5-7-20(19)24-2/h4-9,16H,3,10-15H2,1-2H3.
What are the key properties of 1-[2-(5-ethyl-2-pyridinyl)ethyl]-4-(2-methoxyphenyl)piperazine?
1-[2-(5-ethyl-2-pyridinyl)ethyl]-4-(2-methoxyphenyl)piperazine has a molecular weight of 325.46 g/mol, XLogP of 3.02, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(5-ethyl-2-pyridinyl)ethyl]-4-(2-methoxyphenyl)piperazine is sourced from PubChem (CID 71430224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).