2-ethyl-1-[(6-methoxy-3-pyridinyl)methyl]-5-propylpiperazine

C16H27N3O — CID 64940210

IUPAC2-ethyl-1-[(6-methoxy-3-pyridinyl)methyl]-5-propylpiperazine
SMILESCCCC1CN(Cc2ccc(OC)nc2)C(CC)CN1
InChIInChI=1S/C16H27N3O/c1-4-6-14-12-19(15(5-2)10-17-14)11-13-7-8-16(20-3)18-9-13/h7-9,14-15,17H,4-6,10-12H2,1-3H3
InChIKeyNWFJOAPNJWUUFH-UHFFFAOYSA-N
MW277.41 g/mol
LogP2.44
Rot. Bonds6

About 2-ethyl-1-[(6-methoxy-3-pyridinyl)methyl]-5-propylpiperazine

2-ethyl-1-[(6-methoxy-3-pyridinyl)methyl]-5-propylpiperazine (PubChem CID 64940210) has the molecular formula C16H27N3O and a molecular weight of 277.41 g/mol. Its IUPAC name is 2-ethyl-1-[(6-methoxy-3-pyridinyl)methyl]-5-propylpiperazine.

Molecular Properties

Compound Name2-ethyl-1-[(6-methoxy-3-pyridinyl)methyl]-5-propylpiperazine
PubChem CID64940210
Molecular FormulaC16H27N3O
Molecular Weight277.41 g/mol
Exact Mass277.22
IUPAC Name2-ethyl-1-[(6-methoxy-3-pyridinyl)methyl]-5-propylpiperazine
SMILESCCCC1CN(Cc2ccc(OC)nc2)C(CC)CN1
InChIInChI=1S/C16H27N3O/c1-4-6-14-12-19(15(5-2)10-17-14)11-13-7-8-16(20-3)18-9-13/h7-9,14-15,17H,4-6,10-12H2,1-3H3
InChIKeyNWFJOAPNJWUUFH-UHFFFAOYSA-N
XLogP2.44
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethyl-1-[(1-ethylpyrazol-4-yl)methyl]-5-propylpiperazine
CID 64846772
5-ethyl-1-[(4-methoxyphenyl)methyl]-2-propylpiperazine
CID 64842896
2-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-5-methylpyrazine
CID 64941741
4-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-2-methylpyrimidine
CID 64945783
2-ethyl-1-[(2-methoxy-5-methylphenyl)methyl]-5-propylpiperazine
CID 64845190
1-[(3-chlorophenyl)methyl]-2-ethyl-5-propylpiperazine
CID 64846770
2-ethyl-1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-5-propylpiperazine
CID 82884970
1-[(2-bromo-5-methoxyphenyl)methyl]-2-ethyl-5-propylpiperazine
CID 65331268
2,5-diethyl-1-[(4-ethylphenyl)methyl]piperazine
CID 64842304
2-ethyl-1-[(4-methoxyphenyl)methyl]-5-(2-methylpropyl)piperazine
CID 64848535
1-[(3,4-dichlorophenyl)methyl]-2,5-diethylpiperazine
CID 64842881
1-[(2,4-difluorophenyl)methyl]-2-ethyl-5-propylpiperazine
CID 64845383

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-[(6-methoxy-3-pyridinyl)methyl]-5-propylpiperazine?
The IUPAC name of 2-ethyl-1-[(6-methoxy-3-pyridinyl)methyl]-5-propylpiperazine (CID 64940210) is 2-ethyl-1-[(6-methoxy-3-pyridinyl)methyl]-5-propylpiperazine.
What is the SMILES notation for 2-ethyl-1-[(6-methoxy-3-pyridinyl)methyl]-5-propylpiperazine?
The canonical SMILES for 2-ethyl-1-[(6-methoxy-3-pyridinyl)methyl]-5-propylpiperazine is CCCC1CN(Cc2ccc(OC)nc2)C(CC)CN1.
What is the InChIKey of 2-ethyl-1-[(6-methoxy-3-pyridinyl)methyl]-5-propylpiperazine?
The InChIKey is NWFJOAPNJWUUFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O/c1-4-6-14-12-19(15(5-2)10-17-14)11-13-7-8-16(20-3)18-9-13/h7-9,14-15,17H,4-6,10-12H2,1-3H3.
What are the key properties of 2-ethyl-1-[(6-methoxy-3-pyridinyl)methyl]-5-propylpiperazine?
2-ethyl-1-[(6-methoxy-3-pyridinyl)methyl]-5-propylpiperazine has a molecular weight of 277.41 g/mol, XLogP of 2.44, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-[(6-methoxy-3-pyridinyl)methyl]-5-propylpiperazine is sourced from PubChem (CID 64940210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).