N-phenyl-N-prop-1-en-2-yloxyaniline

C15H15NO — CID 154332789

IUPACN-phenyl-N-prop-1-en-2-yloxyaniline
SMILESC=C(C)ON(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H15NO/c1-13(2)17-16(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12H,1H2,2H3
InChIKeyRBCQDTRBQDUKNI-UHFFFAOYSA-N
MW225.29 g/mol
LogP4.29
Rot. Bonds4

About N-phenyl-N-prop-1-en-2-yloxyaniline

N-phenyl-N-prop-1-en-2-yloxyaniline (PubChem CID 154332789) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is N-phenyl-N-prop-1-en-2-yloxyaniline.

Molecular Properties

Compound NameN-phenyl-N-prop-1-en-2-yloxyaniline
PubChem CID154332789
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC NameN-phenyl-N-prop-1-en-2-yloxyaniline
SMILESC=C(C)ON(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H15NO/c1-13(2)17-16(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12H,1H2,2H3
InChIKeyRBCQDTRBQDUKNI-UHFFFAOYSA-N
XLogP4.29
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 54.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

ethene;N-methyl-N-phenylaniline
CID 144541479
N-methyl-N-[1-(methylideneamino)ethenyl]aniline
CID 166988415
copper;(N-methylanilino) acetate
CID 88782119
N-ethenyl-N-(2-methylprop-1-enyl)aniline
CID 144789627
ethane;bis(N-methyl-N-phenylaniline)
CID 160716887
1-[(2Z)-4-methylpenta-2,4-dien-2-yl]-1-phenylhydrazine
CID 163586551
methyl 2-hydroxy-2-[N-(2-methylprop-2-enoyl)anilino]acetate
CID 139781514
methyl-phenyl-prop-1-en-2-yloxysilane
CID 175224243
(N-methylanilino)phosphanium
CID 163691673
N,N-dimethylaniline;methanol
CID 143205399
bis(2-methylprop-1-ene);toluene
CID 158339604
1,2-bis(prop-1-en-2-yl)benzene;hydrogen peroxide
CID 175029396

Frequently Asked Questions

What is the IUPAC name of N-phenyl-N-prop-1-en-2-yloxyaniline?
The IUPAC name of N-phenyl-N-prop-1-en-2-yloxyaniline (CID 154332789) is N-phenyl-N-prop-1-en-2-yloxyaniline.
What is the SMILES notation for N-phenyl-N-prop-1-en-2-yloxyaniline?
The canonical SMILES for N-phenyl-N-prop-1-en-2-yloxyaniline is C=C(C)ON(c1ccccc1)c1ccccc1.
What is the InChIKey of N-phenyl-N-prop-1-en-2-yloxyaniline?
The InChIKey is RBCQDTRBQDUKNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO/c1-13(2)17-16(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12H,1H2,2H3.
What are the key properties of N-phenyl-N-prop-1-en-2-yloxyaniline?
N-phenyl-N-prop-1-en-2-yloxyaniline has a molecular weight of 225.29 g/mol, XLogP of 4.29, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-N-prop-1-en-2-yloxyaniline is sourced from PubChem (CID 154332789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).