2-methyl-N-phenylprop-2-enamide;styrene

C18H19NO — CID 70398128

IUPAC2-methyl-N-phenylprop-2-enamide;styrene
SMILESC=C(C)C(=O)Nc1ccccc1.C=Cc1ccccc1
InChIInChI=1S/C10H11NO.C8H8/c1-8(2)10(12)11-9-6-4-3-5-7-9;1-2-8-6-4-3-5-7-8/h3-7H,1H2,2H3,(H,11,12);2-7H,1H2
InChIKeyGETBTEZQGYREAT-UHFFFAOYSA-N
MW265.36 g/mol
LogP4.53
Rot. Bonds3

About 2-methyl-N-phenylprop-2-enamide;styrene

2-methyl-N-phenylprop-2-enamide;styrene (PubChem CID 70398128) has the molecular formula C18H19NO and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-methyl-N-phenylprop-2-enamide;styrene.

Molecular Properties

Compound Name2-methyl-N-phenylprop-2-enamide;styrene
PubChem CID70398128
Molecular FormulaC18H19NO
Molecular Weight265.36 g/mol
Exact Mass265.15
IUPAC Name2-methyl-N-phenylprop-2-enamide;styrene
SMILESC=C(C)C(=O)Nc1ccccc1.C=Cc1ccccc1
InChIInChI=1S/C10H11NO.C8H8/c1-8(2)10(12)11-9-6-4-3-5-7-9;1-2-8-6-4-3-5-7-8/h3-7H,1H2,2H3,(H,11,12);2-7H,1H2
InChIKeyGETBTEZQGYREAT-UHFFFAOYSA-N
XLogP4.53
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

methylboronic acid;2-methyl-N-phenylprop-2-enamide
CID 159528809
N-[4-[4-(4-anilinoanilino)anilino]phenyl]-2-methylprop-2-enamide
CID 102428329
ethane;2-methylprop-2-enoic acid;styrene
CID 174478215
bis(buta-1,3-diene);2-methylprop-2-enoic acid;styrene
CID 173015900
N-(3-anilinophenyl)-2-methylprop-2-enamide
CID 67511613
sodium;2-methylprop-2-enoate;styrene
CID 67136540
benzene;buta-1,3-diene;methyl 2-methylprop-2-enoate;styrene
CID 159846921
anthracene;2-methylprop-2-enoic acid;styrene
CID 159809199
(4-ethenylphenyl)carbamic acid
CID 22352089
N-dodecyl-2-methylprop-2-enamide;styrene
CID 174861897
2-anilino-N-phenylprop-2-enamide
CID 20522355
buta-1,3-diene;2-methylprop-1-ene;styrene
CID 159487182

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-phenylprop-2-enamide;styrene?
The IUPAC name of 2-methyl-N-phenylprop-2-enamide;styrene (CID 70398128) is 2-methyl-N-phenylprop-2-enamide;styrene.
What is the SMILES notation for 2-methyl-N-phenylprop-2-enamide;styrene?
The canonical SMILES for 2-methyl-N-phenylprop-2-enamide;styrene is C=C(C)C(=O)Nc1ccccc1.C=Cc1ccccc1.
What is the InChIKey of 2-methyl-N-phenylprop-2-enamide;styrene?
The InChIKey is GETBTEZQGYREAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO.C8H8/c1-8(2)10(12)11-9-6-4-3-5-7-9;1-2-8-6-4-3-5-7-8/h3-7H,1H2,2H3,(H,11,12);2-7H,1H2.
What are the key properties of 2-methyl-N-phenylprop-2-enamide;styrene?
2-methyl-N-phenylprop-2-enamide;styrene has a molecular weight of 265.36 g/mol, XLogP of 4.53, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-phenylprop-2-enamide;styrene is sourced from PubChem (CID 70398128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).