1-N'-(1-tert-butylpiperidin-4-yl)-1-N'-methylethene-1,1-diamine

C12H25N3 — CID 118231389

IUPAC1-N'-(1-tert-butylpiperidin-4-yl)-1-N'-methylethene-1,1-diamine
SMILESC=C(N)N(C)C1CCN(C(C)(C)C)CC1
InChIInChI=1S/C12H25N3/c1-10(13)14(5)11-6-8-15(9-7-11)12(2,3)4/h11H,1,6-9,13H2,2-5H3
InChIKeyFDRYGLHSAADLMA-UHFFFAOYSA-N
MW211.35 g/mol
LogP1.61
Rot. Bonds2

About 1-N'-(1-tert-butylpiperidin-4-yl)-1-N'-methylethene-1,1-diamine

1-N'-(1-tert-butylpiperidin-4-yl)-1-N'-methylethene-1,1-diamine (PubChem CID 118231389) has the molecular formula C12H25N3 and a molecular weight of 211.35 g/mol. Its IUPAC name is 1-N'-(1-tert-butylpiperidin-4-yl)-1-N'-methylethene-1,1-diamine.

Molecular Properties

Compound Name1-N'-(1-tert-butylpiperidin-4-yl)-1-N'-methylethene-1,1-diamine
PubChem CID118231389
Molecular FormulaC12H25N3
Molecular Weight211.35 g/mol
Exact Mass211.20
IUPAC Name1-N'-(1-tert-butylpiperidin-4-yl)-1-N'-methylethene-1,1-diamine
SMILESC=C(N)N(C)C1CCN(C(C)(C)C)CC1
InChIInChI=1S/C12H25N3/c1-10(13)14(5)11-6-8-15(9-7-11)12(2,3)4/h11H,1,6-9,13H2,2-5H3
InChIKeyFDRYGLHSAADLMA-UHFFFAOYSA-N
XLogP1.61
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-N'-(1-tert-butylpiperidin-4-yl)-1-N'-methylethene-1,1-diamine?
The IUPAC name of 1-N'-(1-tert-butylpiperidin-4-yl)-1-N'-methylethene-1,1-diamine (CID 118231389) is 1-N'-(1-tert-butylpiperidin-4-yl)-1-N'-methylethene-1,1-diamine.
What is the SMILES notation for 1-N'-(1-tert-butylpiperidin-4-yl)-1-N'-methylethene-1,1-diamine?
The canonical SMILES for 1-N'-(1-tert-butylpiperidin-4-yl)-1-N'-methylethene-1,1-diamine is C=C(N)N(C)C1CCN(C(C)(C)C)CC1.
What is the InChIKey of 1-N'-(1-tert-butylpiperidin-4-yl)-1-N'-methylethene-1,1-diamine?
The InChIKey is FDRYGLHSAADLMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3/c1-10(13)14(5)11-6-8-15(9-7-11)12(2,3)4/h11H,1,6-9,13H2,2-5H3.
What are the key properties of 1-N'-(1-tert-butylpiperidin-4-yl)-1-N'-methylethene-1,1-diamine?
1-N'-(1-tert-butylpiperidin-4-yl)-1-N'-methylethene-1,1-diamine has a molecular weight of 211.35 g/mol, XLogP of 1.61, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N'-(1-tert-butylpiperidin-4-yl)-1-N'-methylethene-1,1-diamine is sourced from PubChem (CID 118231389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).