(E)-[5-(2,6-difluorophenyl)-2,3-dihydropyrrol-4-ylidene]methanamine

C11H10F2N2 — CID 142161126

IUPAC(E)-[5-(2,6-difluorophenyl)-2,3-dihydropyrrol-4-ylidene]methanamine
SMILESN/C=C1\CCN=C1c1c(F)cccc1F
InChIInChI=1S/C11H10F2N2/c12-8-2-1-3-9(13)10(8)11-7(6-14)4-5-15-11/h1-3,6H,4-5,14H2/b7-6+
InChIKeyYXAOMWLUUZISOW-VOTSOKGWSA-N
MW208.21 g/mol
LogP2.00
Rot. Bonds1

About (E)-[5-(2,6-difluorophenyl)-2,3-dihydropyrrol-4-ylidene]methanamine

(E)-[5-(2,6-difluorophenyl)-2,3-dihydropyrrol-4-ylidene]methanamine (PubChem CID 142161126) has the molecular formula C11H10F2N2 and a molecular weight of 208.21 g/mol. Its IUPAC name is (E)-[5-(2,6-difluorophenyl)-2,3-dihydropyrrol-4-ylidene]methanamine.

Molecular Properties

Compound Name(E)-[5-(2,6-difluorophenyl)-2,3-dihydropyrrol-4-ylidene]methanamine
PubChem CID142161126
Molecular FormulaC11H10F2N2
Molecular Weight208.21 g/mol
Exact Mass208.08
IUPAC Name(E)-[5-(2,6-difluorophenyl)-2,3-dihydropyrrol-4-ylidene]methanamine
SMILESN/C=C1\CCN=C1c1c(F)cccc1F
InChIInChI=1S/C11H10F2N2/c12-8-2-1-3-9(13)10(8)11-7(6-14)4-5-15-11/h1-3,6H,4-5,14H2/b7-6+
InChIKeyYXAOMWLUUZISOW-VOTSOKGWSA-N
XLogP2.00
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.21
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (E)-[5-(2,6-difluorophenyl)-2,3-dihydropyrrol-4-ylidene]methanamine 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-(2,6-difluorophenyl)-1,3-difluorobenzene
CID 13068684
7-bromo-6-chloro-5-(2,6-difluorophenyl)-2,3-dihydro-1H-1,4-benzodiazepine
CID 172737199
4-bromo-5-(2,6-difluorophenyl)-3,4-dihydro-2H-pyrrole
CID 142161112
10-(2,6-difluorophenyl)-13-fluoro-2,4,5,9-tetrazatricyclo[9.4.0.02,6]pentadeca-1(11),3,5,9,12,14-hexaene
CID 21494759
7-fluoro-2,3-dihydro-1H-inden-1-amine
CID 58440160
4-fluoro-5-methyl-9H-fluorene
CID 23235354
2-(2,6-difluorophenyl)cyclobutan-1-amine
CID 81014368
3,6-bis(2,6-difluorophenyl)-1,2,4,5-tetrazine
CID 23362742
4,5-difluoro-9H-fluoren-9-amine
CID 82578575
3,6-bis(2-fluoro-6-methylphenyl)-1,2,4,5-tetrazine
CID 129205135
2-(2,6-difluorophenyl)-4,5,6,7-tetrahydro-1,3-benzothiazol-7-amine
CID 62079496
6-(2,6-difluorophenyl)-2,3-dihydro-1H-inden-1-amine
CID 114265478

Frequently Asked Questions

What is the IUPAC name of (E)-[5-(2,6-difluorophenyl)-2,3-dihydropyrrol-4-ylidene]methanamine?
The IUPAC name of (E)-[5-(2,6-difluorophenyl)-2,3-dihydropyrrol-4-ylidene]methanamine (CID 142161126) is (E)-[5-(2,6-difluorophenyl)-2,3-dihydropyrrol-4-ylidene]methanamine.
What is the SMILES notation for (E)-[5-(2,6-difluorophenyl)-2,3-dihydropyrrol-4-ylidene]methanamine?
The canonical SMILES for (E)-[5-(2,6-difluorophenyl)-2,3-dihydropyrrol-4-ylidene]methanamine is N/C=C1\CCN=C1c1c(F)cccc1F.
What is the InChIKey of (E)-[5-(2,6-difluorophenyl)-2,3-dihydropyrrol-4-ylidene]methanamine?
The InChIKey is YXAOMWLUUZISOW-VOTSOKGWSA-N. The full InChI is InChI=1S/C11H10F2N2/c12-8-2-1-3-9(13)10(8)11-7(6-14)4-5-15-11/h1-3,6H,4-5,14H2/b7-6+.
What are the key properties of (E)-[5-(2,6-difluorophenyl)-2,3-dihydropyrrol-4-ylidene]methanamine?
(E)-[5-(2,6-difluorophenyl)-2,3-dihydropyrrol-4-ylidene]methanamine has a molecular weight of 208.21 g/mol, XLogP of 2.00, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-[5-(2,6-difluorophenyl)-2,3-dihydropyrrol-4-ylidene]methanamine is sourced from PubChem (CID 142161126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).