1-N',2-N'-ditert-butyl-1-N,1-N,2-N,2-N-tetramethylethanediimidamide

C14H30N4 — CID 87338661

IUPAC1-N',2-N'-ditert-butyl-1-N,1-N,2-N,2-N-tetramethylethanediimidamide
SMILESCN(C)C(=N\C(C)(C)C)/C(=N/C(C)(C)C)N(C)C
InChIInChI=1S/C14H30N4/c1-13(2,3)15-11(17(7)8)12(18(9)10)16-14(4,5)6/h1-10H3/b15-11-,16-12-
InChIKeyDOPNLCQWWPBMIM-NFLUSIDLSA-N
MW254.42 g/mol
LogP2.50
Rot. Bonds

About 1-N',2-N'-ditert-butyl-1-N,1-N,2-N,2-N-tetramethylethanediimidamide

1-N',2-N'-ditert-butyl-1-N,1-N,2-N,2-N-tetramethylethanediimidamide (PubChem CID 87338661) has the molecular formula C14H30N4 and a molecular weight of 254.42 g/mol. Its IUPAC name is 1-N',2-N'-ditert-butyl-1-N,1-N,2-N,2-N-tetramethylethanediimidamide.

Molecular Properties

Compound Name1-N',2-N'-ditert-butyl-1-N,1-N,2-N,2-N-tetramethylethanediimidamide
PubChem CID87338661
Molecular FormulaC14H30N4
Molecular Weight254.42 g/mol
Exact Mass254.25
IUPAC Name1-N',2-N'-ditert-butyl-1-N,1-N,2-N,2-N-tetramethylethanediimidamide
SMILESCN(C)C(=N\C(C)(C)C)/C(=N/C(C)(C)C)N(C)C
InChIInChI=1S/C14H30N4/c1-13(2,3)15-11(17(7)8)12(18(9)10)16-14(4,5)6/h1-10H3/b15-11-,16-12-
InChIKeyDOPNLCQWWPBMIM-NFLUSIDLSA-N
XLogP2.50
TPSA31.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.50
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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Frequently Asked Questions

What is the IUPAC name of 1-N',2-N'-ditert-butyl-1-N,1-N,2-N,2-N-tetramethylethanediimidamide?
The IUPAC name of 1-N',2-N'-ditert-butyl-1-N,1-N,2-N,2-N-tetramethylethanediimidamide (CID 87338661) is 1-N',2-N'-ditert-butyl-1-N,1-N,2-N,2-N-tetramethylethanediimidamide.
What is the SMILES notation for 1-N',2-N'-ditert-butyl-1-N,1-N,2-N,2-N-tetramethylethanediimidamide?
The canonical SMILES for 1-N',2-N'-ditert-butyl-1-N,1-N,2-N,2-N-tetramethylethanediimidamide is CN(C)C(=N\C(C)(C)C)/C(=N/C(C)(C)C)N(C)C.
What is the InChIKey of 1-N',2-N'-ditert-butyl-1-N,1-N,2-N,2-N-tetramethylethanediimidamide?
The InChIKey is DOPNLCQWWPBMIM-NFLUSIDLSA-N. The full InChI is InChI=1S/C14H30N4/c1-13(2,3)15-11(17(7)8)12(18(9)10)16-14(4,5)6/h1-10H3/b15-11-,16-12-.
What are the key properties of 1-N',2-N'-ditert-butyl-1-N,1-N,2-N,2-N-tetramethylethanediimidamide?
1-N',2-N'-ditert-butyl-1-N,1-N,2-N,2-N-tetramethylethanediimidamide has a molecular weight of 254.42 g/mol, XLogP of 2.50, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N',2-N'-ditert-butyl-1-N,1-N,2-N,2-N-tetramethylethanediimidamide is sourced from PubChem (CID 87338661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).