2-ethyl-1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-5-propylpiperazine

C17H29N3O — CID 82884970

IUPAC2-ethyl-1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-5-propylpiperazine
SMILESCCCC1CN(Cc2cc(OC)cc(C)n2)C(CC)CN1
InChIInChI=1S/C17H29N3O/c1-5-7-14-11-20(16(6-2)10-18-14)12-15-9-17(21-4)8-13(3)19-15/h8-9,14,16,18H,5-7,10-12H2,1-4H3
InChIKeyMYOULAOCULNYDX-UHFFFAOYSA-N
MW291.44 g/mol
LogP2.75
Rot. Bonds6

About 2-ethyl-1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-5-propylpiperazine

2-ethyl-1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-5-propylpiperazine (PubChem CID 82884970) has the molecular formula C17H29N3O and a molecular weight of 291.44 g/mol. Its IUPAC name is 2-ethyl-1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-5-propylpiperazine.

Molecular Properties

Compound Name2-ethyl-1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-5-propylpiperazine
PubChem CID82884970
Molecular FormulaC17H29N3O
Molecular Weight291.44 g/mol
Exact Mass291.23
IUPAC Name2-ethyl-1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-5-propylpiperazine
SMILESCCCC1CN(Cc2cc(OC)cc(C)n2)C(CC)CN1
InChIInChI=1S/C17H29N3O/c1-5-7-14-11-20(16(6-2)10-18-14)12-15-9-17(21-4)8-13(3)19-15/h8-9,14,16,18H,5-7,10-12H2,1-4H3
InChIKeyMYOULAOCULNYDX-UHFFFAOYSA-N
XLogP2.75
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-ethyl-1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-5-propylpiperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-ethyl-1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-2-propylpiperazine
CID 82885141
1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-3-propylpiperazine
CID 82895805
2-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-5-methylpyrazine
CID 64941741
4-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-2-methylpyrimidine
CID 64945783
1-[(2-bromo-5-methoxyphenyl)methyl]-2-ethyl-5-propylpiperazine
CID 65331268
2-ethyl-1-[(2-methoxy-5-methylphenyl)methyl]-5-propylpiperazine
CID 64845190
2-ethyl-1-[(6-methoxy-3-pyridinyl)methyl]-5-propylpiperazine
CID 64940210
5-ethyl-1-[(4-methoxyphenyl)methyl]-2-propylpiperazine
CID 64842896
2-methyl-1-[(6-methyl-2-pyridinyl)methyl]-5-propylpiperazine
CID 64947937
4-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole
CID 106043590
1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-3,5-dimethylpiperazine
CID 82893576
1-[(3-chlorophenyl)methyl]-2-ethyl-5-propylpiperazine
CID 64846770

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-5-propylpiperazine?
The IUPAC name of 2-ethyl-1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-5-propylpiperazine (CID 82884970) is 2-ethyl-1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-5-propylpiperazine.
What is the SMILES notation for 2-ethyl-1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-5-propylpiperazine?
The canonical SMILES for 2-ethyl-1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-5-propylpiperazine is CCCC1CN(Cc2cc(OC)cc(C)n2)C(CC)CN1.
What is the InChIKey of 2-ethyl-1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-5-propylpiperazine?
The InChIKey is MYOULAOCULNYDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3O/c1-5-7-14-11-20(16(6-2)10-18-14)12-15-9-17(21-4)8-13(3)19-15/h8-9,14,16,18H,5-7,10-12H2,1-4H3.
What are the key properties of 2-ethyl-1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-5-propylpiperazine?
2-ethyl-1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-5-propylpiperazine has a molecular weight of 291.44 g/mol, XLogP of 2.75, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-5-propylpiperazine is sourced from PubChem (CID 82884970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).