N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropanamide

C10H20N2O — CID 12649587

IUPACN-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropanamide
SMILESCC(C)(C)/C=N/NC(=O)C(C)(C)C
InChIInChI=1S/C10H20N2O/c1-9(2,3)7-11-12-8(13)10(4,5)6/h7H,1-6H3,(H,12,13)/b11-7+
InChIKeyCGXDNXAYMLHFOC-YRNVUSSQSA-N
MW184.28 g/mol
LogP2.18
Rot. Bonds1

About N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropanamide

N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropanamide (PubChem CID 12649587) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropanamide
PubChem CID12649587
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC NameN-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropanamide
SMILESCC(C)(C)/C=N/NC(=O)C(C)(C)C
InChIInChI=1S/C10H20N2O/c1-9(2,3)7-11-12-8(13)10(4,5)6/h7H,1-6H3,(H,12,13)/b11-7+
InChIKeyCGXDNXAYMLHFOC-YRNVUSSQSA-N
XLogP2.18
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.18
H-Bond Donors ≤ 51
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 N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropanamide?
The IUPAC name of N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropanamide (CID 12649587) is N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropanamide?
The canonical SMILES for N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropanamide is CC(C)(C)/C=N/NC(=O)C(C)(C)C.
What is the InChIKey of N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropanamide?
The InChIKey is CGXDNXAYMLHFOC-YRNVUSSQSA-N. The full InChI is InChI=1S/C10H20N2O/c1-9(2,3)7-11-12-8(13)10(4,5)6/h7H,1-6H3,(H,12,13)/b11-7+.
What are the key properties of N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropanamide?
N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropanamide has a molecular weight of 184.28 g/mol, XLogP of 2.18, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-2,2-dimethylpropylideneamino]-2,2-dimethylpropanamide is sourced from PubChem (CID 12649587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).