3,3-dimethyl-1-propan-2-ylpiperazine

C9H20N2 — CID 19893332

IUPAC3,3-dimethyl-1-propan-2-ylpiperazine
SMILESCC(C)N1CCNC(C)(C)C1
InChIInChI=1S/C9H20N2/c1-8(2)11-6-5-10-9(3,4)7-11/h8,10H,5-7H2,1-4H3
InChIKeyIUKJUAUZZCBXBM-UHFFFAOYSA-N
MW156.27 g/mol
LogP1.08
Rot. Bonds1

About 3,3-dimethyl-1-propan-2-ylpiperazine

3,3-dimethyl-1-propan-2-ylpiperazine (PubChem CID 19893332) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is 3,3-dimethyl-1-propan-2-ylpiperazine.

Molecular Properties

Compound Name3,3-dimethyl-1-propan-2-ylpiperazine
PubChem CID19893332
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Name3,3-dimethyl-1-propan-2-ylpiperazine
SMILESCC(C)N1CCNC(C)(C)C1
InChIInChI=1S/C9H20N2/c1-8(2)11-6-5-10-9(3,4)7-11/h8,10H,5-7H2,1-4H3
InChIKeyIUKJUAUZZCBXBM-UHFFFAOYSA-N
XLogP1.08
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-1-propan-2-ylpiperazine?
The IUPAC name of 3,3-dimethyl-1-propan-2-ylpiperazine (CID 19893332) is 3,3-dimethyl-1-propan-2-ylpiperazine.
What is the SMILES notation for 3,3-dimethyl-1-propan-2-ylpiperazine?
The canonical SMILES for 3,3-dimethyl-1-propan-2-ylpiperazine is CC(C)N1CCNC(C)(C)C1.
What is the InChIKey of 3,3-dimethyl-1-propan-2-ylpiperazine?
The InChIKey is IUKJUAUZZCBXBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2/c1-8(2)11-6-5-10-9(3,4)7-11/h8,10H,5-7H2,1-4H3.
What are the key properties of 3,3-dimethyl-1-propan-2-ylpiperazine?
3,3-dimethyl-1-propan-2-ylpiperazine has a molecular weight of 156.27 g/mol, XLogP of 1.08, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-1-propan-2-ylpiperazine is sourced from PubChem (CID 19893332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).