2,3-bis[bis(prop-2-enyl)amino]phenol

C18H24N2O — CID 141359055

IUPAC2,3-bis[bis(prop-2-enyl)amino]phenol
SMILESC=CCN(CC=C)c1cccc(O)c1N(CC=C)CC=C
InChIInChI=1S/C18H24N2O/c1-5-12-19(13-6-2)16-10-9-11-17(21)18(16)20(14-7-3)15-8-4/h5-11,21H,1-4,12-15H2
InChIKeyIDARPJRUYGBVTN-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.75
Rot. Bonds10

About 2,3-bis[bis(prop-2-enyl)amino]phenol

2,3-bis[bis(prop-2-enyl)amino]phenol (PubChem CID 141359055) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 2,3-bis[bis(prop-2-enyl)amino]phenol.

Molecular Properties

Compound Name2,3-bis[bis(prop-2-enyl)amino]phenol
PubChem CID141359055
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name2,3-bis[bis(prop-2-enyl)amino]phenol
SMILESC=CCN(CC=C)c1cccc(O)c1N(CC=C)CC=C
InChIInChI=1S/C18H24N2O/c1-5-12-19(13-6-2)16-10-9-11-17(21)18(16)20(14-7-3)15-8-4/h5-11,21H,1-4,12-15H2
InChIKeyIDARPJRUYGBVTN-UHFFFAOYSA-N
XLogP3.75
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2,3-bis[bis(prop-2-enyl)amino]phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[bis(prop-2-enyl)amino]benzenethiol
CID 67687576
N,N-bis(prop-2-enyl)anthracen-1-amine
CID 118977865
1-[2-[bis(prop-2-enyl)amino]-6-methoxyphenyl]ethanone
CID 113388829
2,3-bis(dipentylamino)phenol
CID 67225665
2-N,2-N-bis(prop-2-enyl)benzene-1,2-diamine;but-1-ene
CID 175301373
2-[bis(prop-2-enyl)amino]-4,5-bis(prop-2-enyl)phenol
CID 67813640
2-(1-aminoethyl)-3-fluoro-N,N-bis(prop-2-enyl)aniline
CID 43188702
2-[bis(prop-2-enyl)amino]-6-methoxycarbonylbenzoic acid
CID 70624885
(E)-3-[2-[bis(prop-2-enyl)amino]phenyl]-1-phenylprop-2-en-1-one
CID 70278104
2-[1-(methylamino)ethyl]-N,N-bis(prop-2-enyl)aniline
CID 43283871
2-[(1S)-1-aminoethyl]-3-methoxy-N,N-bis(prop-2-enyl)aniline
CID 113388926
(1S)-1-[2-[ethyl(prop-2-enyl)amino]phenyl]propan-1-ol
CID 103960311

Frequently Asked Questions

What is the IUPAC name of 2,3-bis[bis(prop-2-enyl)amino]phenol?
The IUPAC name of 2,3-bis[bis(prop-2-enyl)amino]phenol (CID 141359055) is 2,3-bis[bis(prop-2-enyl)amino]phenol.
What is the SMILES notation for 2,3-bis[bis(prop-2-enyl)amino]phenol?
The canonical SMILES for 2,3-bis[bis(prop-2-enyl)amino]phenol is C=CCN(CC=C)c1cccc(O)c1N(CC=C)CC=C.
What is the InChIKey of 2,3-bis[bis(prop-2-enyl)amino]phenol?
The InChIKey is IDARPJRUYGBVTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-5-12-19(13-6-2)16-10-9-11-17(21)18(16)20(14-7-3)15-8-4/h5-11,21H,1-4,12-15H2.
What are the key properties of 2,3-bis[bis(prop-2-enyl)amino]phenol?
2,3-bis[bis(prop-2-enyl)amino]phenol has a molecular weight of 284.40 g/mol, XLogP of 3.75, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis[bis(prop-2-enyl)amino]phenol is sourced from PubChem (CID 141359055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).