2-methyl-2-(4-propan-2-ylpiperazin-1-yl)propan-1-amine

C11H25N3 — CID 43585088

IUPAC2-methyl-2-(4-propan-2-ylpiperazin-1-yl)propan-1-amine
SMILESCC(C)N1CCN(C(C)(C)CN)CC1
InChIInChI=1S/C11H25N3/c1-10(2)13-5-7-14(8-6-13)11(3,4)9-12/h10H,5-9,12H2,1-4H3
InChIKeyLKOITKUFFQGGDT-UHFFFAOYSA-N
MW199.34 g/mol
LogP0.75
Rot. Bonds3

About 2-methyl-2-(4-propan-2-ylpiperazin-1-yl)propan-1-amine

2-methyl-2-(4-propan-2-ylpiperazin-1-yl)propan-1-amine (PubChem CID 43585088) has the molecular formula C11H25N3 and a molecular weight of 199.34 g/mol. Its IUPAC name is 2-methyl-2-(4-propan-2-ylpiperazin-1-yl)propan-1-amine.

Molecular Properties

Compound Name2-methyl-2-(4-propan-2-ylpiperazin-1-yl)propan-1-amine
PubChem CID43585088
Molecular FormulaC11H25N3
Molecular Weight199.34 g/mol
Exact Mass199.20
IUPAC Name2-methyl-2-(4-propan-2-ylpiperazin-1-yl)propan-1-amine
SMILESCC(C)N1CCN(C(C)(C)CN)CC1
InChIInChI=1S/C11H25N3/c1-10(2)13-5-7-14(8-6-13)11(3,4)9-12/h10H,5-9,12H2,1-4H3
InChIKeyLKOITKUFFQGGDT-UHFFFAOYSA-N
XLogP0.75
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(4-propan-2-ylpiperazin-1-yl)propan-1-amine?
The IUPAC name of 2-methyl-2-(4-propan-2-ylpiperazin-1-yl)propan-1-amine (CID 43585088) is 2-methyl-2-(4-propan-2-ylpiperazin-1-yl)propan-1-amine.
What is the SMILES notation for 2-methyl-2-(4-propan-2-ylpiperazin-1-yl)propan-1-amine?
The canonical SMILES for 2-methyl-2-(4-propan-2-ylpiperazin-1-yl)propan-1-amine is CC(C)N1CCN(C(C)(C)CN)CC1.
What is the InChIKey of 2-methyl-2-(4-propan-2-ylpiperazin-1-yl)propan-1-amine?
The InChIKey is LKOITKUFFQGGDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3/c1-10(2)13-5-7-14(8-6-13)11(3,4)9-12/h10H,5-9,12H2,1-4H3.
What are the key properties of 2-methyl-2-(4-propan-2-ylpiperazin-1-yl)propan-1-amine?
2-methyl-2-(4-propan-2-ylpiperazin-1-yl)propan-1-amine has a molecular weight of 199.34 g/mol, XLogP of 0.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(4-propan-2-ylpiperazin-1-yl)propan-1-amine is sourced from PubChem (CID 43585088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).