(3Z)-3-[(Z)-but-2-enylidene]-2-methylidene-N-naphthalen-2-yl-1-benzofuran-6-amine

C23H19NO — CID 145276869

IUPAC(3Z)-3-[(Z)-but-2-enylidene]-2-methylidene-N-naphthalen-2-yl-1-benzofuran-6-amine
SMILESC=c1oc2cc(Nc3ccc4ccccc4c3)ccc2/c1=C/C=C\C
InChIInChI=1S/C23H19NO/c1-3-4-9-21-16(2)25-23-15-20(12-13-22(21)23)24-19-11-10-17-7-5-6-8-18(17)14-19/h3-15,24H,2H2,1H3/b4-3-,21-9+
InChIKeyYBTZMMCXDPQTDU-BRDVXRHQSA-N
MW325.41 g/mol
LogP5.10
Rot. Bonds3

About (3Z)-3-[(Z)-but-2-enylidene]-2-methylidene-N-naphthalen-2-yl-1-benzofuran-6-amine

(3Z)-3-[(Z)-but-2-enylidene]-2-methylidene-N-naphthalen-2-yl-1-benzofuran-6-amine (PubChem CID 145276869) has the molecular formula C23H19NO and a molecular weight of 325.41 g/mol. Its IUPAC name is (3Z)-3-[(Z)-but-2-enylidene]-2-methylidene-N-naphthalen-2-yl-1-benzofuran-6-amine.

Molecular Properties

Compound Name(3Z)-3-[(Z)-but-2-enylidene]-2-methylidene-N-naphthalen-2-yl-1-benzofuran-6-amine
PubChem CID145276869
Molecular FormulaC23H19NO
Molecular Weight325.41 g/mol
Exact Mass325.15
IUPAC Name(3Z)-3-[(Z)-but-2-enylidene]-2-methylidene-N-naphthalen-2-yl-1-benzofuran-6-amine
SMILESC=c1oc2cc(Nc3ccc4ccccc4c3)ccc2/c1=C/C=C\C
InChIInChI=1S/C23H19NO/c1-3-4-9-21-16(2)25-23-15-20(12-13-22(21)23)24-19-11-10-17-7-5-6-8-18(17)14-19/h3-15,24H,2H2,1H3/b4-3-,21-9+
InChIKeyYBTZMMCXDPQTDU-BRDVXRHQSA-N
XLogP5.10
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500325.41
LogP ≤ 55.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (3Z)-3-[(Z)-but-2-enylidene]-2-methylidene-N-naphthalen-2-yl-1-benzofuran-6-amine 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

1-N,4-N-dinaphthalen-2-ylbenzene-1,4-diamine
CID 7142
(3Z)-3-[(Z)-but-2-enylidene]-N-ethyl-2-methylidene-1-benzofuran-5-amine;chloromethane;1-fluoro-2-methylbenzene
CID 142075848
N-pentacen-2-ylpentacen-2-amine
CID 91227915
N-(3,4-dimethylphenyl)naphthalen-2-amine;N-methylnaphthalen-2-amine
CID 145088499
N-[4-[(3E,5Z)-hepta-1,3,5-trien-4-yl]phenyl]naphthalen-2-amine
CID 145442455
N-[(2E,4Z)-hepta-2,4,6-trien-3-yl]naphthalen-2-amine
CID 145073167
N-hexa-2,4-dienylnaphthalen-2-amine
CID 123968148
N-[(2E,4Z)-hexa-2,4-dien-2-yl]naphthalen-2-amine
CID 145138026
N-dibenzofuran-2-yldibenzofuran-3-amine;ethane
CID 145077285
2-N,6-N-diphenylnaphthalene-2,6-diamine
CID 12541294
ethane;6-methyl-N-phenyl-5-[(Z)-prop-1-enyl]naphthalen-2-amine
CID 145232526
4-N,4-N-dimethyl-1-N-naphthalen-2-ylbenzene-1,4-diamine
CID 82536280

Frequently Asked Questions

What is the IUPAC name of (3Z)-3-[(Z)-but-2-enylidene]-2-methylidene-N-naphthalen-2-yl-1-benzofuran-6-amine?
The IUPAC name of (3Z)-3-[(Z)-but-2-enylidene]-2-methylidene-N-naphthalen-2-yl-1-benzofuran-6-amine (CID 145276869) is (3Z)-3-[(Z)-but-2-enylidene]-2-methylidene-N-naphthalen-2-yl-1-benzofuran-6-amine.
What is the SMILES notation for (3Z)-3-[(Z)-but-2-enylidene]-2-methylidene-N-naphthalen-2-yl-1-benzofuran-6-amine?
The canonical SMILES for (3Z)-3-[(Z)-but-2-enylidene]-2-methylidene-N-naphthalen-2-yl-1-benzofuran-6-amine is C=c1oc2cc(Nc3ccc4ccccc4c3)ccc2/c1=C/C=C\C.
What is the InChIKey of (3Z)-3-[(Z)-but-2-enylidene]-2-methylidene-N-naphthalen-2-yl-1-benzofuran-6-amine?
The InChIKey is YBTZMMCXDPQTDU-BRDVXRHQSA-N. The full InChI is InChI=1S/C23H19NO/c1-3-4-9-21-16(2)25-23-15-20(12-13-22(21)23)24-19-11-10-17-7-5-6-8-18(17)14-19/h3-15,24H,2H2,1H3/b4-3-,21-9+.
What are the key properties of (3Z)-3-[(Z)-but-2-enylidene]-2-methylidene-N-naphthalen-2-yl-1-benzofuran-6-amine?
(3Z)-3-[(Z)-but-2-enylidene]-2-methylidene-N-naphthalen-2-yl-1-benzofuran-6-amine has a molecular weight of 325.41 g/mol, XLogP of 5.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-3-[(Z)-but-2-enylidene]-2-methylidene-N-naphthalen-2-yl-1-benzofuran-6-amine is sourced from PubChem (CID 145276869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).