(4Z)-4-(furan-2-ylmethylidene)-2,3-dihydropyrrole

C9H9NO — CID 91748325

IUPAC(4Z)-4-(furan-2-ylmethylidene)-2,3-dihydropyrrole
SMILESC1=NCC/C1=C/c1ccco1
InChIInChI=1S/C9H9NO/c1-2-9(11-5-1)6-8-3-4-10-7-8/h1-2,5-7H,3-4H2/b8-6-
InChIKeyUEGNEKZXKDRCHZ-VURMDHGXSA-N
MW147.18 g/mol
LogP2.14
Rot. Bonds1

About (4Z)-4-(furan-2-ylmethylidene)-2,3-dihydropyrrole

(4Z)-4-(furan-2-ylmethylidene)-2,3-dihydropyrrole (PubChem CID 91748325) has the molecular formula C9H9NO and a molecular weight of 147.18 g/mol. Its IUPAC name is (4Z)-4-(furan-2-ylmethylidene)-2,3-dihydropyrrole.

Molecular Properties

Compound Name(4Z)-4-(furan-2-ylmethylidene)-2,3-dihydropyrrole
PubChem CID91748325
Molecular FormulaC9H9NO
Molecular Weight147.18 g/mol
Exact Mass147.07
IUPAC Name(4Z)-4-(furan-2-ylmethylidene)-2,3-dihydropyrrole
SMILESC1=NCC/C1=C/c1ccco1
InChIInChI=1S/C9H9NO/c1-2-9(11-5-1)6-8-3-4-10-7-8/h1-2,5-7H,3-4H2/b8-6-
InChIKeyUEGNEKZXKDRCHZ-VURMDHGXSA-N
XLogP2.14
TPSA25.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.18
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4Z)-4-(furan-2-ylmethylidene)-2,3-dihydropyrrole?
The IUPAC name of (4Z)-4-(furan-2-ylmethylidene)-2,3-dihydropyrrole (CID 91748325) is (4Z)-4-(furan-2-ylmethylidene)-2,3-dihydropyrrole.
What is the SMILES notation for (4Z)-4-(furan-2-ylmethylidene)-2,3-dihydropyrrole?
The canonical SMILES for (4Z)-4-(furan-2-ylmethylidene)-2,3-dihydropyrrole is C1=NCC/C1=C/c1ccco1.
What is the InChIKey of (4Z)-4-(furan-2-ylmethylidene)-2,3-dihydropyrrole?
The InChIKey is UEGNEKZXKDRCHZ-VURMDHGXSA-N. The full InChI is InChI=1S/C9H9NO/c1-2-9(11-5-1)6-8-3-4-10-7-8/h1-2,5-7H,3-4H2/b8-6-.
What are the key properties of (4Z)-4-(furan-2-ylmethylidene)-2,3-dihydropyrrole?
(4Z)-4-(furan-2-ylmethylidene)-2,3-dihydropyrrole has a molecular weight of 147.18 g/mol, XLogP of 2.14, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-4-(furan-2-ylmethylidene)-2,3-dihydropyrrole is sourced from PubChem (CID 91748325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).