2-(2,2,6,6-tetramethylpiperidin-4-yl)guanidine

C10H22N4 — CID 7176005

IUPAC2-(2,2,6,6-tetramethylpiperidin-4-yl)guanidine
SMILESCC1(C)CC(N=C(N)N)CC(C)(C)N1
InChIInChI=1S/C10H22N4/c1-9(2)5-7(13-8(11)12)6-10(3,4)14-9/h7,14H,5-6H2,1-4H3,(H4,11,12,13)
InChIKeyAYLPVOFHYZCDCJ-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.57
Rot. Bonds1

About 2-(2,2,6,6-tetramethylpiperidin-4-yl)guanidine

2-(2,2,6,6-tetramethylpiperidin-4-yl)guanidine (PubChem CID 7176005) has the molecular formula C10H22N4 and a molecular weight of 198.31 g/mol. Its IUPAC name is 2-(2,2,6,6-tetramethylpiperidin-4-yl)guanidine.

Molecular Properties

Compound Name2-(2,2,6,6-tetramethylpiperidin-4-yl)guanidine
PubChem CID7176005
Molecular FormulaC10H22N4
Molecular Weight198.31 g/mol
Exact Mass198.18
IUPAC Name2-(2,2,6,6-tetramethylpiperidin-4-yl)guanidine
SMILESCC1(C)CC(N=C(N)N)CC(C)(C)N1
InChIInChI=1S/C10H22N4/c1-9(2)5-7(13-8(11)12)6-10(3,4)14-9/h7,14H,5-6H2,1-4H3,(H4,11,12,13)
InChIKeyAYLPVOFHYZCDCJ-UHFFFAOYSA-N
XLogP0.57
TPSA76.43 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2,2,6,6-tetramethylpiperidin-4-yl)guanidine?
The IUPAC name of 2-(2,2,6,6-tetramethylpiperidin-4-yl)guanidine (CID 7176005) is 2-(2,2,6,6-tetramethylpiperidin-4-yl)guanidine.
What is the SMILES notation for 2-(2,2,6,6-tetramethylpiperidin-4-yl)guanidine?
The canonical SMILES for 2-(2,2,6,6-tetramethylpiperidin-4-yl)guanidine is CC1(C)CC(N=C(N)N)CC(C)(C)N1.
What is the InChIKey of 2-(2,2,6,6-tetramethylpiperidin-4-yl)guanidine?
The InChIKey is AYLPVOFHYZCDCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N4/c1-9(2)5-7(13-8(11)12)6-10(3,4)14-9/h7,14H,5-6H2,1-4H3,(H4,11,12,13).
What are the key properties of 2-(2,2,6,6-tetramethylpiperidin-4-yl)guanidine?
2-(2,2,6,6-tetramethylpiperidin-4-yl)guanidine has a molecular weight of 198.31 g/mol, XLogP of 0.57, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2,6,6-tetramethylpiperidin-4-yl)guanidine is sourced from PubChem (CID 7176005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).