(4-methylidene-6,7-dihydro-2H-pyrano[3,4-c]pyrrol-1-yl)methanol

C9H11NO2 — CID 59887412

IUPAC(4-methylidene-6,7-dihydro-2H-pyrano[3,4-c]pyrrol-1-yl)methanol
SMILESC=C1OCCc2c1c[nH]c2CO
InChIInChI=1S/C9H11NO2/c1-6-8-4-10-9(5-11)7(8)2-3-12-6/h4,10-11H,1-3,5H2
InChIKeyNOGJILVLCLZDJY-UHFFFAOYSA-N
MW165.19 g/mol
LogP1.05
Rot. Bonds1

About (4-methylidene-6,7-dihydro-2H-pyrano[3,4-c]pyrrol-1-yl)methanol

(4-methylidene-6,7-dihydro-2H-pyrano[3,4-c]pyrrol-1-yl)methanol (PubChem CID 59887412) has the molecular formula C9H11NO2 and a molecular weight of 165.19 g/mol. Its IUPAC name is (4-methylidene-6,7-dihydro-2H-pyrano[3,4-c]pyrrol-1-yl)methanol.

Molecular Properties

Compound Name(4-methylidene-6,7-dihydro-2H-pyrano[3,4-c]pyrrol-1-yl)methanol
PubChem CID59887412
Molecular FormulaC9H11NO2
Molecular Weight165.19 g/mol
Exact Mass165.08
IUPAC Name(4-methylidene-6,7-dihydro-2H-pyrano[3,4-c]pyrrol-1-yl)methanol
SMILESC=C1OCCc2c1c[nH]c2CO
InChIInChI=1S/C9H11NO2/c1-6-8-4-10-9(5-11)7(8)2-3-12-6/h4,10-11H,1-3,5H2
InChIKeyNOGJILVLCLZDJY-UHFFFAOYSA-N
XLogP1.05
TPSA45.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.19
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-methylidene-6,7-dihydro-2H-pyrano[3,4-c]pyrrol-1-yl)methanol?
The IUPAC name of (4-methylidene-6,7-dihydro-2H-pyrano[3,4-c]pyrrol-1-yl)methanol (CID 59887412) is (4-methylidene-6,7-dihydro-2H-pyrano[3,4-c]pyrrol-1-yl)methanol.
What is the SMILES notation for (4-methylidene-6,7-dihydro-2H-pyrano[3,4-c]pyrrol-1-yl)methanol?
The canonical SMILES for (4-methylidene-6,7-dihydro-2H-pyrano[3,4-c]pyrrol-1-yl)methanol is C=C1OCCc2c1c[nH]c2CO.
What is the InChIKey of (4-methylidene-6,7-dihydro-2H-pyrano[3,4-c]pyrrol-1-yl)methanol?
The InChIKey is NOGJILVLCLZDJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO2/c1-6-8-4-10-9(5-11)7(8)2-3-12-6/h4,10-11H,1-3,5H2.
What are the key properties of (4-methylidene-6,7-dihydro-2H-pyrano[3,4-c]pyrrol-1-yl)methanol?
(4-methylidene-6,7-dihydro-2H-pyrano[3,4-c]pyrrol-1-yl)methanol has a molecular weight of 165.19 g/mol, XLogP of 1.05, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylidene-6,7-dihydro-2H-pyrano[3,4-c]pyrrol-1-yl)methanol is sourced from PubChem (CID 59887412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).