1-(6-methylhept-1-en-2-yl)-4-propylpiperazine

C15H30N2 — CID 156802760

IUPAC1-(6-methylhept-1-en-2-yl)-4-propylpiperazine
SMILESC=C(CCCC(C)C)N1CCN(CCC)CC1
InChIInChI=1S/C15H30N2/c1-5-9-16-10-12-17(13-11-16)15(4)8-6-7-14(2)3/h14H,4-13H2,1-3H3
InChIKeyCMDCQXSNQFGODZ-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.35
Rot. Bonds7

About 1-(6-methylhept-1-en-2-yl)-4-propylpiperazine

1-(6-methylhept-1-en-2-yl)-4-propylpiperazine (PubChem CID 156802760) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 1-(6-methylhept-1-en-2-yl)-4-propylpiperazine.

Molecular Properties

Compound Name1-(6-methylhept-1-en-2-yl)-4-propylpiperazine
PubChem CID156802760
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name1-(6-methylhept-1-en-2-yl)-4-propylpiperazine
SMILESC=C(CCCC(C)C)N1CCN(CCC)CC1
InChIInChI=1S/C15H30N2/c1-5-9-16-10-12-17(13-11-16)15(4)8-6-7-14(2)3/h14H,4-13H2,1-3H3
InChIKeyCMDCQXSNQFGODZ-UHFFFAOYSA-N
XLogP3.35
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(6-methylhept-1-en-2-yl)-4-propylpiperazine?
The IUPAC name of 1-(6-methylhept-1-en-2-yl)-4-propylpiperazine (CID 156802760) is 1-(6-methylhept-1-en-2-yl)-4-propylpiperazine.
What is the SMILES notation for 1-(6-methylhept-1-en-2-yl)-4-propylpiperazine?
The canonical SMILES for 1-(6-methylhept-1-en-2-yl)-4-propylpiperazine is C=C(CCCC(C)C)N1CCN(CCC)CC1.
What is the InChIKey of 1-(6-methylhept-1-en-2-yl)-4-propylpiperazine?
The InChIKey is CMDCQXSNQFGODZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-5-9-16-10-12-17(13-11-16)15(4)8-6-7-14(2)3/h14H,4-13H2,1-3H3.
What are the key properties of 1-(6-methylhept-1-en-2-yl)-4-propylpiperazine?
1-(6-methylhept-1-en-2-yl)-4-propylpiperazine has a molecular weight of 238.42 g/mol, XLogP of 3.35, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methylhept-1-en-2-yl)-4-propylpiperazine is sourced from PubChem (CID 156802760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).