2-methyl-4,4-diphenylbut-3-en-2-amine

C17H19N — CID 11118093

IUPAC2-methyl-4,4-diphenylbut-3-en-2-amine
SMILESCC(C)(N)C=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19N/c1-17(2,18)13-16(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13H,18H2,1-2H3
InChIKeyIMALXKZETUAMPG-UHFFFAOYSA-N
MW237.35 g/mol
LogP3.86
Rot. Bonds3

About 2-methyl-4,4-diphenylbut-3-en-2-amine

2-methyl-4,4-diphenylbut-3-en-2-amine (PubChem CID 11118093) has the molecular formula C17H19N and a molecular weight of 237.35 g/mol. Its IUPAC name is 2-methyl-4,4-diphenylbut-3-en-2-amine.

Molecular Properties

Compound Name2-methyl-4,4-diphenylbut-3-en-2-amine
PubChem CID11118093
Molecular FormulaC17H19N
Molecular Weight237.35 g/mol
Exact Mass237.15
IUPAC Name2-methyl-4,4-diphenylbut-3-en-2-amine
SMILESCC(C)(N)C=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19N/c1-17(2,18)13-16(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13H,18H2,1-2H3
InChIKeyIMALXKZETUAMPG-UHFFFAOYSA-N
XLogP3.86
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3,3-difluoro-1-phenylbut-1-enyl)benzene
CID 174901374
(NE)-N-[2-(2,2-diphenylethenyl)-2-methyl-4,4-diphenylbut-3-enylidene]hydroxylamine
CID 11743387
(E)-3,3-dimethyl-1-phenylbut-1-en-1-amine
CID 67619754
[(2,2-dimethyl-4,4-diphenylbut-3-enyl)-iodoboranyl]phosphane
CID 21027985
boric acid;2,3-dimethylbutane-2,3-diol;1,2-diphenylethenylbenzene
CID 175481277
2-[2-[(E)-1,2-diphenylethenyl]phenyl]propan-2-amine
CID 102527150
1-[(Z)-4-bromo-3,3,4,4-tetrafluoro-1-phenylbut-1-enyl]-4-methylbenzene
CID 132943042
[(E)-(2,2-dimethyl-4,4-diphenylbut-3-enylidene)amino] benzoate
CID 15636099
(E)-2-ethenyl-N-methoxy-2-methyl-4,4-diphenylbut-3-en-1-imine
CID 10979181
[(E)-[2-(2,2-diphenylethenyl)-2-methyl-4,4-diphenylbut-3-enylidene]amino] acetate
CID 10412497
N-[(2S)-2-amino-1-oxopropan-2-yl]benzamide
CID 174758628
4,4-diphenylbut-3-en-2-one;hydrazine
CID 158754130

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4,4-diphenylbut-3-en-2-amine?
The IUPAC name of 2-methyl-4,4-diphenylbut-3-en-2-amine (CID 11118093) is 2-methyl-4,4-diphenylbut-3-en-2-amine.
What is the SMILES notation for 2-methyl-4,4-diphenylbut-3-en-2-amine?
The canonical SMILES for 2-methyl-4,4-diphenylbut-3-en-2-amine is CC(C)(N)C=C(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-methyl-4,4-diphenylbut-3-en-2-amine?
The InChIKey is IMALXKZETUAMPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N/c1-17(2,18)13-16(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13H,18H2,1-2H3.
What are the key properties of 2-methyl-4,4-diphenylbut-3-en-2-amine?
2-methyl-4,4-diphenylbut-3-en-2-amine has a molecular weight of 237.35 g/mol, XLogP of 3.86, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4,4-diphenylbut-3-en-2-amine is sourced from PubChem (CID 11118093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).