2-methyl-5-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine

C16H32N2 — CID 79350021

IUPAC2-methyl-5-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine
SMILESCC(C)C1CN(CC2C(C)(C)C2(C)C)C(C)CN1
InChIInChI=1S/C16H32N2/c1-11(2)13-9-18(12(3)8-17-13)10-14-15(4,5)16(14,6)7/h11-14,17H,8-10H2,1-7H3
InChIKeyDJEXHLRVMJBOMH-UHFFFAOYSA-N
MW252.45 g/mol
LogP2.99
Rot. Bonds3

About 2-methyl-5-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine

2-methyl-5-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine (PubChem CID 79350021) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 2-methyl-5-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine.

Molecular Properties

Compound Name2-methyl-5-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine
PubChem CID79350021
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name2-methyl-5-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine
SMILESCC(C)C1CN(CC2C(C)(C)C2(C)C)C(C)CN1
InChIInChI=1S/C16H32N2/c1-11(2)13-9-18(12(3)8-17-13)10-14-15(4,5)16(14,6)7/h11-14,17H,8-10H2,1-7H3
InChIKeyDJEXHLRVMJBOMH-UHFFFAOYSA-N
XLogP2.99
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine?
The IUPAC name of 2-methyl-5-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine (CID 79350021) is 2-methyl-5-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine.
What is the SMILES notation for 2-methyl-5-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine?
The canonical SMILES for 2-methyl-5-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine is CC(C)C1CN(CC2C(C)(C)C2(C)C)C(C)CN1.
What is the InChIKey of 2-methyl-5-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine?
The InChIKey is DJEXHLRVMJBOMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-11(2)13-9-18(12(3)8-17-13)10-14-15(4,5)16(14,6)7/h11-14,17H,8-10H2,1-7H3.
What are the key properties of 2-methyl-5-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine?
2-methyl-5-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine has a molecular weight of 252.45 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine is sourced from PubChem (CID 79350021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).