1-(2-methylpentan-2-yl)-4-propylpiperazine

C13H28N2 — CID 170790911

IUPAC1-(2-methylpentan-2-yl)-4-propylpiperazine
SMILESCCCN1CCN(C(C)(C)CCC)CC1
InChIInChI=1S/C13H28N2/c1-5-7-13(3,4)15-11-9-14(8-6-2)10-12-15/h5-12H2,1-4H3
InChIKeyXRHYOPGTHGEMHL-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.59
Rot. Bonds5

About 1-(2-methylpentan-2-yl)-4-propylpiperazine

1-(2-methylpentan-2-yl)-4-propylpiperazine (PubChem CID 170790911) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is 1-(2-methylpentan-2-yl)-4-propylpiperazine.

Molecular Properties

Compound Name1-(2-methylpentan-2-yl)-4-propylpiperazine
PubChem CID170790911
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name1-(2-methylpentan-2-yl)-4-propylpiperazine
SMILESCCCN1CCN(C(C)(C)CCC)CC1
InChIInChI=1S/C13H28N2/c1-5-7-13(3,4)15-11-9-14(8-6-2)10-12-15/h5-12H2,1-4H3
InChIKeyXRHYOPGTHGEMHL-UHFFFAOYSA-N
XLogP2.59
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-tert-butyl-4-propylpiperazine
CID 58721754
2-methyl-2-[(4-propylpiperazin-1-yl)methyl]pentan-1-ol
CID 62270175
2-methyl-2-(4-nonylpiperazin-1-yl)propan-1-amine
CID 63343718
1-ethyl-4-(2,4,4-trimethylpentan-2-yl)piperazine
CID 143657095
2-(4-ethylpiperazin-1-yl)-2-methylpropan-1-amine
CID 9161367
1-propyl-4-(2-pyrrolidin-1-ylethyl)piperazine
CID 135208810
4-methoxy-1-(2-methylpentan-2-yl)piperidine
CID 146178496
2,4-dimethyl-2-(4-propylpiperazin-1-yl)pentan-1-amine
CID 24705230
1,4,7,10-tetrakis(2-methylbutan-2-yl)-1,4,7,10-tetrazacyclododecane
CID 139847650
4-(3-methylbutan-2-yl)-1-(2-methylpentan-2-yl)piperidine
CID 167228555
2,2-dimethyl-3-(4-propylpiperazin-1-yl)propan-1-amine
CID 62263340
2-methyl-1-(4-propylpiperazin-1-yl)butan-2-ol
CID 114495323

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpentan-2-yl)-4-propylpiperazine?
The IUPAC name of 1-(2-methylpentan-2-yl)-4-propylpiperazine (CID 170790911) is 1-(2-methylpentan-2-yl)-4-propylpiperazine.
What is the SMILES notation for 1-(2-methylpentan-2-yl)-4-propylpiperazine?
The canonical SMILES for 1-(2-methylpentan-2-yl)-4-propylpiperazine is CCCN1CCN(C(C)(C)CCC)CC1.
What is the InChIKey of 1-(2-methylpentan-2-yl)-4-propylpiperazine?
The InChIKey is XRHYOPGTHGEMHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-5-7-13(3,4)15-11-9-14(8-6-2)10-12-15/h5-12H2,1-4H3.
What are the key properties of 1-(2-methylpentan-2-yl)-4-propylpiperazine?
1-(2-methylpentan-2-yl)-4-propylpiperazine has a molecular weight of 212.38 g/mol, XLogP of 2.59, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpentan-2-yl)-4-propylpiperazine is sourced from PubChem (CID 170790911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).