2-[2-(dimethylamino)-2-methylpropyl]-1,1,3,3-tetramethylguanidine

C11H26N4 — CID 111028726

IUPAC2-[2-(dimethylamino)-2-methylpropyl]-1,1,3,3-tetramethylguanidine
SMILESCN(C)C(=NCC(C)(C)N(C)C)N(C)C
InChIInChI=1S/C11H26N4/c1-11(2,15(7)8)9-12-10(13(3)4)14(5)6/h9H2,1-8H3
InChIKeyODBNYQMBIUIJBG-UHFFFAOYSA-N
MW214.36 g/mol
LogP0.81
Rot. Bonds3

About 2-[2-(dimethylamino)-2-methylpropyl]-1,1,3,3-tetramethylguanidine

2-[2-(dimethylamino)-2-methylpropyl]-1,1,3,3-tetramethylguanidine (PubChem CID 111028726) has the molecular formula C11H26N4 and a molecular weight of 214.36 g/mol. Its IUPAC name is 2-[2-(dimethylamino)-2-methylpropyl]-1,1,3,3-tetramethylguanidine.

Molecular Properties

Compound Name2-[2-(dimethylamino)-2-methylpropyl]-1,1,3,3-tetramethylguanidine
PubChem CID111028726
Molecular FormulaC11H26N4
Molecular Weight214.36 g/mol
Exact Mass214.22
IUPAC Name2-[2-(dimethylamino)-2-methylpropyl]-1,1,3,3-tetramethylguanidine
SMILESCN(C)C(=NCC(C)(C)N(C)C)N(C)C
InChIInChI=1S/C11H26N4/c1-11(2,15(7)8)9-12-10(13(3)4)14(5)6/h9H2,1-8H3
InChIKeyODBNYQMBIUIJBG-UHFFFAOYSA-N
XLogP0.81
TPSA22.08 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.36
LogP ≤ 50.81
H-Bond Donors ≤ 50
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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Related Compounds

3-[bis(dimethylamino)methylideneamino]-2,2-dimethylpropanamide;hydroiodide
CID 111072590
2-[2-(dimethylamino)-2-methylpropyl]-1-propan-2-ylguanidine;hydroiodide
CID 110912360
2-(2,2-dimethyl-3-phenylpropyl)-1,1,3,3-tetramethylguanidine;hydroiodide
CID 111815533
2-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-1,1,3,3-tetramethylguanidine;hydroiodide
CID 111080124
2-[2-(3-bromophenyl)-2-methylpropyl]-1,1,3,3-tetramethylguanidine
CID 111096283
2-[2-(dimethylamino)-2-methylpropyl]-1-ethyl-3-hexylguanidine
CID 111161073
2-(2-methoxy-3,3-dimethylbutyl)-1,1,3,3-tetramethylguanidine;hydroiodide
CID 111757968
2-(2-iodoethyl)-1,1,3,3-tetramethylguanidine
CID 90350369
tert-butyl N-[3-[[bis(dimethylamino)methylideneamino]methyl]pentan-3-yl]carbamate;hydroiodide
CID 111757918
2-[2-(3-bromophenyl)-2-methylpropyl]-1,1,3,3-tetramethylguanidine;hydroiodide
CID 111096282
2-[2-(dimethylamino)-2-methylpropyl]-1-(3,5-dimethylphenyl)guanidine;hydroiodide
CID 111028695
4-acetyl-N'-[2-(dimethylamino)-2-methylpropyl]-N-ethylpiperazine-1-carboximidamide
CID 110963403

Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)-2-methylpropyl]-1,1,3,3-tetramethylguanidine?
The IUPAC name of 2-[2-(dimethylamino)-2-methylpropyl]-1,1,3,3-tetramethylguanidine (CID 111028726) is 2-[2-(dimethylamino)-2-methylpropyl]-1,1,3,3-tetramethylguanidine.
What is the SMILES notation for 2-[2-(dimethylamino)-2-methylpropyl]-1,1,3,3-tetramethylguanidine?
The canonical SMILES for 2-[2-(dimethylamino)-2-methylpropyl]-1,1,3,3-tetramethylguanidine is CN(C)C(=NCC(C)(C)N(C)C)N(C)C.
What is the InChIKey of 2-[2-(dimethylamino)-2-methylpropyl]-1,1,3,3-tetramethylguanidine?
The InChIKey is ODBNYQMBIUIJBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N4/c1-11(2,15(7)8)9-12-10(13(3)4)14(5)6/h9H2,1-8H3.
What are the key properties of 2-[2-(dimethylamino)-2-methylpropyl]-1,1,3,3-tetramethylguanidine?
2-[2-(dimethylamino)-2-methylpropyl]-1,1,3,3-tetramethylguanidine has a molecular weight of 214.36 g/mol, XLogP of 0.81, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)-2-methylpropyl]-1,1,3,3-tetramethylguanidine is sourced from PubChem (CID 111028726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).