N-tert-butyl-N,N'-dimethylmethanimidamide

C7H16N2 — CID 19385153

IUPACN-tert-butyl-N,N'-dimethylmethanimidamide
SMILESC/N=C/N(C)C(C)(C)C
InChIInChI=1S/C7H16N2/c1-7(2,3)9(5)6-8-4/h6H,1-5H3/b8-6+
InChIKeyJTSCIJOSJASYEB-SOFGYWHQSA-N
MW128.22 g/mol
LogP1.37
Rot. Bonds1

About N-tert-butyl-N,N'-dimethylmethanimidamide

N-tert-butyl-N,N'-dimethylmethanimidamide (PubChem CID 19385153) has the molecular formula C7H16N2 and a molecular weight of 128.22 g/mol. Its IUPAC name is N-tert-butyl-N,N'-dimethylmethanimidamide.

Molecular Properties

Compound NameN-tert-butyl-N,N'-dimethylmethanimidamide
PubChem CID19385153
Molecular FormulaC7H16N2
Molecular Weight128.22 g/mol
Exact Mass128.13
IUPAC NameN-tert-butyl-N,N'-dimethylmethanimidamide
SMILESC/N=C/N(C)C(C)(C)C
InChIInChI=1S/C7H16N2/c1-7(2,3)9(5)6-8-4/h6H,1-5H3/b8-6+
InChIKeyJTSCIJOSJASYEB-SOFGYWHQSA-N
XLogP1.37
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

N'-(1,1-Dimethylethyl)-N,N-dimethylmethanimidamide
CID 520047
(Tert-butylamino)methylidene-dimethylazanium
CID 18462341
N-tert-butyl-N,N'-dimethylcarbamimidoyl chloride
CID 21655991
N'-tert-butyl-N,N-diethylmethanimidamide
CID 58319947
N,N-ditert-butyl-N'-methylmethanimidamide
CID 58319996
N-tert-butyl-N-ethyl-N'-methylmethanimidamide
CID 58320043
N'-tert-butyl-N-ethyl-N-methylmethanimidamide
CID 58320080
N-tert-butyl-N'-methyl-N-propan-2-ylmethanimidamide
CID 58320128
N,N'-Di-tert-butyl-N-methylmethanimidamide
CID 71373184
N'-tert-butyl-N,N-dibutylmethanimidamide
CID 86026486
N-tert-butyl-N,N'-diethylmethanimidamide
CID 88359688
N-tert-butyl-N-methyl-N'-(methylideneamino)methanimidamide
CID 88859907

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-N,N'-dimethylmethanimidamide?
The IUPAC name of N-tert-butyl-N,N'-dimethylmethanimidamide (CID 19385153) is N-tert-butyl-N,N'-dimethylmethanimidamide.
What is the SMILES notation for N-tert-butyl-N,N'-dimethylmethanimidamide?
The canonical SMILES for N-tert-butyl-N,N'-dimethylmethanimidamide is C/N=C/N(C)C(C)(C)C.
What is the InChIKey of N-tert-butyl-N,N'-dimethylmethanimidamide?
The InChIKey is JTSCIJOSJASYEB-SOFGYWHQSA-N. The full InChI is InChI=1S/C7H16N2/c1-7(2,3)9(5)6-8-4/h6H,1-5H3/b8-6+.
What are the key properties of N-tert-butyl-N,N'-dimethylmethanimidamide?
N-tert-butyl-N,N'-dimethylmethanimidamide has a molecular weight of 128.22 g/mol, XLogP of 1.37, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-N,N'-dimethylmethanimidamide is sourced from PubChem (CID 19385153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).