3-(1,2-dihydropyrrol-3-ylidenemethyl)-2H-pyrrole

C9H10N2 — CID 59096491

IUPAC3-(1,2-dihydropyrrol-3-ylidenemethyl)-2H-pyrrole
SMILESC1=CC(=CC2=CC=NC2)CN1
InChIInChI=1S/C9H10N2/c1-3-10-6-8(1)5-9-2-4-11-7-9/h1-5,10H,6-7H2
InChIKeyDKGQGVJYJPPUDO-UHFFFAOYSA-N
MW146.19 g/mol
LogP1.04
Rot. Bonds1

About 3-(1,2-dihydropyrrol-3-ylidenemethyl)-2H-pyrrole

3-(1,2-dihydropyrrol-3-ylidenemethyl)-2H-pyrrole (PubChem CID 59096491) has the molecular formula C9H10N2 and a molecular weight of 146.19 g/mol. Its IUPAC name is 3-(1,2-dihydropyrrol-3-ylidenemethyl)-2H-pyrrole.

Molecular Properties

Compound Name3-(1,2-dihydropyrrol-3-ylidenemethyl)-2H-pyrrole
PubChem CID59096491
Molecular FormulaC9H10N2
Molecular Weight146.19 g/mol
Exact Mass146.08
IUPAC Name3-(1,2-dihydropyrrol-3-ylidenemethyl)-2H-pyrrole
SMILESC1=CC(=CC2=CC=NC2)CN1
InChIInChI=1S/C9H10N2/c1-3-10-6-8(1)5-9-2-4-11-7-9/h1-5,10H,6-7H2
InChIKeyDKGQGVJYJPPUDO-UHFFFAOYSA-N
XLogP1.04
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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10-methyl-9-methylidene-8H-pyrrolo[2,3-d]azonine
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CID 121232937
1,8a-Dihydro-1,8-naphthyridine
CID 18988805
1-methyl-3-[(1-methyl-2H-pyrrol-1-ium-3-yl)methylidene]-2H-pyrrole
CID 54207140
[(2E)-3,7-dimethyl-9-(methylamino)nona-2,4,6,8-tetraenylidene]-methylazanium
CID 54465705
1,7-Dihydropyrrolo[3,2-c]azepine
CID 56997363
1,5-Dihydropyrrolo[2,3-c]azepine
CID 57325040
3-(1,3-dihydropyrrol-3-id-2-yl)-2H-pyridin-2-ide;yttrium
CID 58813407
3-(1,2-dihydropyrrol-2-id-3-yl)-2H-pyridin-2-ide;yttrium
CID 58813466
3-(2H-pyrrol-1-id-3-ylidenemethyl)-2H-pyrrole;scandium
CID 59096490
2-Selena-3-aza-1-azoniatricyclo[6.2.1.13,6]dodeca-1(10),4,6,8-tetraene
CID 59096505

Frequently Asked Questions

What is the IUPAC name of 3-(1,2-dihydropyrrol-3-ylidenemethyl)-2H-pyrrole?
The IUPAC name of 3-(1,2-dihydropyrrol-3-ylidenemethyl)-2H-pyrrole (CID 59096491) is 3-(1,2-dihydropyrrol-3-ylidenemethyl)-2H-pyrrole.
What is the SMILES notation for 3-(1,2-dihydropyrrol-3-ylidenemethyl)-2H-pyrrole?
The canonical SMILES for 3-(1,2-dihydropyrrol-3-ylidenemethyl)-2H-pyrrole is C1=CC(=CC2=CC=NC2)CN1.
What is the InChIKey of 3-(1,2-dihydropyrrol-3-ylidenemethyl)-2H-pyrrole?
The InChIKey is DKGQGVJYJPPUDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2/c1-3-10-6-8(1)5-9-2-4-11-7-9/h1-5,10H,6-7H2.
What are the key properties of 3-(1,2-dihydropyrrol-3-ylidenemethyl)-2H-pyrrole?
3-(1,2-dihydropyrrol-3-ylidenemethyl)-2H-pyrrole has a molecular weight of 146.19 g/mol, XLogP of 1.04, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,2-dihydropyrrol-3-ylidenemethyl)-2H-pyrrole is sourced from PubChem (CID 59096491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).