(Z)-N-[(Z)-3,3-dimethylbutan-2-ylideneamino]-3,3-dimethylbutan-2-imine

C12H24N2 — CID 102252877

IUPAC(Z)-N-[(Z)-3,3-dimethylbutan-2-ylideneamino]-3,3-dimethylbutan-2-imine
SMILESC/C(=N/N=C(/C)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C12H24N2/c1-9(11(3,4)5)13-14-10(2)12(6,7)8/h1-8H3/b13-9-,14-10-
InChIKeyMYKADEMIRVFALV-FOIMCPNXSA-N
MW196.34 g/mol
LogP3.92
Rot. Bonds1

About (Z)-N-[(Z)-3,3-dimethylbutan-2-ylideneamino]-3,3-dimethylbutan-2-imine

(Z)-N-[(Z)-3,3-dimethylbutan-2-ylideneamino]-3,3-dimethylbutan-2-imine (PubChem CID 102252877) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is (Z)-N-[(Z)-3,3-dimethylbutan-2-ylideneamino]-3,3-dimethylbutan-2-imine.

Molecular Properties

Compound Name(Z)-N-[(Z)-3,3-dimethylbutan-2-ylideneamino]-3,3-dimethylbutan-2-imine
PubChem CID102252877
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name(Z)-N-[(Z)-3,3-dimethylbutan-2-ylideneamino]-3,3-dimethylbutan-2-imine
SMILESC/C(=N/N=C(/C)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C12H24N2/c1-9(11(3,4)5)13-14-10(2)12(6,7)8/h1-8H3/b13-9-,14-10-
InChIKeyMYKADEMIRVFALV-FOIMCPNXSA-N
XLogP3.92
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 53.92
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 (Z)-N-[(Z)-3,3-dimethylbutan-2-ylideneamino]-3,3-dimethylbutan-2-imine?
The IUPAC name of (Z)-N-[(Z)-3,3-dimethylbutan-2-ylideneamino]-3,3-dimethylbutan-2-imine (CID 102252877) is (Z)-N-[(Z)-3,3-dimethylbutan-2-ylideneamino]-3,3-dimethylbutan-2-imine.
What is the SMILES notation for (Z)-N-[(Z)-3,3-dimethylbutan-2-ylideneamino]-3,3-dimethylbutan-2-imine?
The canonical SMILES for (Z)-N-[(Z)-3,3-dimethylbutan-2-ylideneamino]-3,3-dimethylbutan-2-imine is C/C(=N/N=C(/C)C(C)(C)C)C(C)(C)C.
What is the InChIKey of (Z)-N-[(Z)-3,3-dimethylbutan-2-ylideneamino]-3,3-dimethylbutan-2-imine?
The InChIKey is MYKADEMIRVFALV-FOIMCPNXSA-N. The full InChI is InChI=1S/C12H24N2/c1-9(11(3,4)5)13-14-10(2)12(6,7)8/h1-8H3/b13-9-,14-10-.
What are the key properties of (Z)-N-[(Z)-3,3-dimethylbutan-2-ylideneamino]-3,3-dimethylbutan-2-imine?
(Z)-N-[(Z)-3,3-dimethylbutan-2-ylideneamino]-3,3-dimethylbutan-2-imine has a molecular weight of 196.34 g/mol, XLogP of 3.92, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-[(Z)-3,3-dimethylbutan-2-ylideneamino]-3,3-dimethylbutan-2-imine is sourced from PubChem (CID 102252877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).