(E)-N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropan-1-imine

C10H20N2 — CID 12635406

IUPAC(E)-N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropan-1-imine
SMILESCC(C)(C)/C=N/N=C/C(C)(C)C
InChIInChI=1S/C10H20N2/c1-9(2,3)7-11-12-8-10(4,5)6/h7-8H,1-6H3/b11-7+,12-8+
InChIKeyFQKCIYLEQYBWAA-MKICQXMISA-N
MW168.28 g/mol
LogP3.14
Rot. Bonds1

About (E)-N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropan-1-imine

(E)-N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropan-1-imine (PubChem CID 12635406) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is (E)-N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropan-1-imine.

Molecular Properties

Compound Name(E)-N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropan-1-imine
PubChem CID12635406
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name(E)-N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropan-1-imine
SMILESCC(C)(C)/C=N/N=C/C(C)(C)C
InChIInChI=1S/C10H20N2/c1-9(2,3)7-11-12-8-10(4,5)6/h7-8H,1-6H3/b11-7+,12-8+
InChIKeyFQKCIYLEQYBWAA-MKICQXMISA-N
XLogP3.14
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (E)-N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropan-1-imine?
The IUPAC name of (E)-N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropan-1-imine (CID 12635406) is (E)-N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropan-1-imine.
What is the SMILES notation for (E)-N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropan-1-imine?
The canonical SMILES for (E)-N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropan-1-imine is CC(C)(C)/C=N/N=C/C(C)(C)C.
What is the InChIKey of (E)-N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropan-1-imine?
The InChIKey is FQKCIYLEQYBWAA-MKICQXMISA-N. The full InChI is InChI=1S/C10H20N2/c1-9(2,3)7-11-12-8-10(4,5)6/h7-8H,1-6H3/b11-7+,12-8+.
What are the key properties of (E)-N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropan-1-imine?
(E)-N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropan-1-imine has a molecular weight of 168.28 g/mol, XLogP of 3.14, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropan-1-imine is sourced from PubChem (CID 12635406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).