2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]aniline

C19H17NO — CID 11173418

IUPAC2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]aniline
SMILESCOc1ccc(/C=C\c2ccc3ccccc3c2)cc1N
InChIInChI=1S/C19H17NO/c1-21-19-11-9-15(13-18(19)20)7-6-14-8-10-16-4-2-3-5-17(16)12-14/h2-13H,20H2,1H3/b7-6-
InChIKeyHZTPITOOFSOVEQ-SREVYHEPSA-N
MW275.35 g/mol
LogP4.60
Rot. Bonds3

About 2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]aniline

2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]aniline (PubChem CID 11173418) has the molecular formula C19H17NO and a molecular weight of 275.35 g/mol. Its IUPAC name is 2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]aniline.

Molecular Properties

Compound Name2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]aniline
PubChem CID11173418
Molecular FormulaC19H17NO
Molecular Weight275.35 g/mol
Exact Mass275.13
IUPAC Name2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]aniline
SMILESCOc1ccc(/C=C\c2ccc3ccccc3c2)cc1N
InChIInChI=1S/C19H17NO/c1-21-19-11-9-15(13-18(19)20)7-6-14-8-10-16-4-2-3-5-17(16)12-14/h2-13H,20H2,1H3/b7-6-
InChIKeyHZTPITOOFSOVEQ-SREVYHEPSA-N
XLogP4.60
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(2-Naphthyloxy)aniline
CID 2302295
4-[(E)-2-[3-[(E)-2-(4-amino-3-methoxyphenyl)ethenyl]phenyl]ethenyl]-2-methoxyaniline
CID 24785954
5-[(E)-2-[3-[(E)-2-(3-amino-4-methoxyphenyl)ethenyl]phenyl]ethenyl]-2-methoxyaniline
CID 24786217
3-Amino-17-methylene-2-methoxyestra-1,3,5(10)-triene
CID 46882565
2-Methoxynaphthalen-1-amine
CID 75252
5-Phenyl-o-anisidine
CID 123489
2,3-dimethoxy-5-[(Z)-2-naphthalen-2-ylethenyl]aniline
CID 11174230
2,3-dimethoxy-5-[(E)-2-naphthalen-2-ylethenyl]aniline
CID 11301193
(8S,9S,13S,14S,17E)-17-ethylidene-2-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-amine
CID 46882566
5-[(3-Amino-4-methoxyphenyl)methyl]-2-methoxyaniline
CID 796517
(8S,9S,13S,14S)-2-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-amine
CID 46882567
N-[2-Methoxy-4-(6-methoxy-2-naphthyl)phenyl]acetamide
CID 59443454

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]aniline?
The IUPAC name of 2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]aniline (CID 11173418) is 2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]aniline.
What is the SMILES notation for 2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]aniline?
The canonical SMILES for 2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]aniline is COc1ccc(/C=C\c2ccc3ccccc3c2)cc1N.
What is the InChIKey of 2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]aniline?
The InChIKey is HZTPITOOFSOVEQ-SREVYHEPSA-N. The full InChI is InChI=1S/C19H17NO/c1-21-19-11-9-15(13-18(19)20)7-6-14-8-10-16-4-2-3-5-17(16)12-14/h2-13H,20H2,1H3/b7-6-.
What are the key properties of 2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]aniline?
2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]aniline has a molecular weight of 275.35 g/mol, XLogP of 4.60, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]aniline is sourced from PubChem (CID 11173418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).