(1-methyl-3,4,6,6a-tetrahydro-2H-furo[3,4-b]pyrrol-3a-yl)methanol

C8H15NO2 — CID 166819002

IUPAC(1-methyl-3,4,6,6a-tetrahydro-2H-furo[3,4-b]pyrrol-3a-yl)methanol
SMILESCN1CCC2(CO)COCC12
InChIInChI=1S/C8H15NO2/c1-9-3-2-8(5-10)6-11-4-7(8)9/h7,10H,2-6H2,1H3
InChIKeyBIKICWTUWQSSAV-UHFFFAOYSA-N
MW157.21 g/mol
LogP-0.30
Rot. Bonds1

About (1-methyl-3,4,6,6a-tetrahydro-2H-furo[3,4-b]pyrrol-3a-yl)methanol

(1-methyl-3,4,6,6a-tetrahydro-2H-furo[3,4-b]pyrrol-3a-yl)methanol (PubChem CID 166819002) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is (1-methyl-3,4,6,6a-tetrahydro-2H-furo[3,4-b]pyrrol-3a-yl)methanol.

Molecular Properties

Compound Name(1-methyl-3,4,6,6a-tetrahydro-2H-furo[3,4-b]pyrrol-3a-yl)methanol
PubChem CID166819002
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Name(1-methyl-3,4,6,6a-tetrahydro-2H-furo[3,4-b]pyrrol-3a-yl)methanol
SMILESCN1CCC2(CO)COCC12
InChIInChI=1S/C8H15NO2/c1-9-3-2-8(5-10)6-11-4-7(8)9/h7,10H,2-6H2,1H3
InChIKeyBIKICWTUWQSSAV-UHFFFAOYSA-N
XLogP-0.30
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 5-0.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1-methyl-3,4,6,6a-tetrahydro-2H-furo[3,4-b]pyrrol-3a-yl)methanol?
The IUPAC name of (1-methyl-3,4,6,6a-tetrahydro-2H-furo[3,4-b]pyrrol-3a-yl)methanol (CID 166819002) is (1-methyl-3,4,6,6a-tetrahydro-2H-furo[3,4-b]pyrrol-3a-yl)methanol.
What is the SMILES notation for (1-methyl-3,4,6,6a-tetrahydro-2H-furo[3,4-b]pyrrol-3a-yl)methanol?
The canonical SMILES for (1-methyl-3,4,6,6a-tetrahydro-2H-furo[3,4-b]pyrrol-3a-yl)methanol is CN1CCC2(CO)COCC12.
What is the InChIKey of (1-methyl-3,4,6,6a-tetrahydro-2H-furo[3,4-b]pyrrol-3a-yl)methanol?
The InChIKey is BIKICWTUWQSSAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-9-3-2-8(5-10)6-11-4-7(8)9/h7,10H,2-6H2,1H3.
What are the key properties of (1-methyl-3,4,6,6a-tetrahydro-2H-furo[3,4-b]pyrrol-3a-yl)methanol?
(1-methyl-3,4,6,6a-tetrahydro-2H-furo[3,4-b]pyrrol-3a-yl)methanol has a molecular weight of 157.21 g/mol, XLogP of -0.30, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methyl-3,4,6,6a-tetrahydro-2H-furo[3,4-b]pyrrol-3a-yl)methanol is sourced from PubChem (CID 166819002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).