2,2-dimethyl-N'-(2-methyl-1-phenylpropan-2-yl)propanimidamide

C15H24N2 — CID 113360565

IUPAC2,2-dimethyl-N'-(2-methyl-1-phenylpropan-2-yl)propanimidamide
SMILESCC(C)(Cc1ccccc1)/N=C(\N)C(C)(C)C
InChIInChI=1S/C15H24N2/c1-14(2,3)13(16)17-15(4,5)11-12-9-7-6-8-10-12/h6-10H,11H2,1-5H3,(H2,16,17)
InChIKeyFSISFXQIIMQNGZ-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.41
Rot. Bonds3

About 2,2-dimethyl-N'-(2-methyl-1-phenylpropan-2-yl)propanimidamide

2,2-dimethyl-N'-(2-methyl-1-phenylpropan-2-yl)propanimidamide (PubChem CID 113360565) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 2,2-dimethyl-N'-(2-methyl-1-phenylpropan-2-yl)propanimidamide.

Molecular Properties

Compound Name2,2-dimethyl-N'-(2-methyl-1-phenylpropan-2-yl)propanimidamide
PubChem CID113360565
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name2,2-dimethyl-N'-(2-methyl-1-phenylpropan-2-yl)propanimidamide
SMILESCC(C)(Cc1ccccc1)/N=C(\N)C(C)(C)C
InChIInChI=1S/C15H24N2/c1-14(2,3)13(16)17-15(4,5)11-12-9-7-6-8-10-12/h6-10H,11H2,1-5H3,(H2,16,17)
InChIKeyFSISFXQIIMQNGZ-UHFFFAOYSA-N
XLogP3.41
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.41
H-Bond Donors ≤ 51
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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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N'-(2-methyl-1-phenylpropan-2-yl)propanimidamide?
The IUPAC name of 2,2-dimethyl-N'-(2-methyl-1-phenylpropan-2-yl)propanimidamide (CID 113360565) is 2,2-dimethyl-N'-(2-methyl-1-phenylpropan-2-yl)propanimidamide.
What is the SMILES notation for 2,2-dimethyl-N'-(2-methyl-1-phenylpropan-2-yl)propanimidamide?
The canonical SMILES for 2,2-dimethyl-N'-(2-methyl-1-phenylpropan-2-yl)propanimidamide is CC(C)(Cc1ccccc1)/N=C(\N)C(C)(C)C.
What is the InChIKey of 2,2-dimethyl-N'-(2-methyl-1-phenylpropan-2-yl)propanimidamide?
The InChIKey is FSISFXQIIMQNGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-14(2,3)13(16)17-15(4,5)11-12-9-7-6-8-10-12/h6-10H,11H2,1-5H3,(H2,16,17).
What are the key properties of 2,2-dimethyl-N'-(2-methyl-1-phenylpropan-2-yl)propanimidamide?
2,2-dimethyl-N'-(2-methyl-1-phenylpropan-2-yl)propanimidamide has a molecular weight of 232.37 g/mol, XLogP of 3.41, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N'-(2-methyl-1-phenylpropan-2-yl)propanimidamide is sourced from PubChem (CID 113360565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).