furan-3-yl-(3,4,5-trimethyl-1H-pyrrol-2-yl)methanol

C12H15NO2 — CID 63927081

IUPACfuran-3-yl-(3,4,5-trimethyl-1H-pyrrol-2-yl)methanol
SMILESCc1[nH]c(C(O)c2ccoc2)c(C)c1C
InChIInChI=1S/C12H15NO2/c1-7-8(2)11(13-9(7)3)12(14)10-4-5-15-6-10/h4-6,12-14H,1-3H3
InChIKeyNUJPNYQFYRHKBK-UHFFFAOYSA-N
MW205.26 g/mol
LogP2.61
Rot. Bonds2

About furan-3-yl-(3,4,5-trimethyl-1H-pyrrol-2-yl)methanol

furan-3-yl-(3,4,5-trimethyl-1H-pyrrol-2-yl)methanol (PubChem CID 63927081) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is furan-3-yl-(3,4,5-trimethyl-1H-pyrrol-2-yl)methanol.

Molecular Properties

Compound Namefuran-3-yl-(3,4,5-trimethyl-1H-pyrrol-2-yl)methanol
PubChem CID63927081
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC Namefuran-3-yl-(3,4,5-trimethyl-1H-pyrrol-2-yl)methanol
SMILESCc1[nH]c(C(O)c2ccoc2)c(C)c1C
InChIInChI=1S/C12H15NO2/c1-7-8(2)11(13-9(7)3)12(14)10-4-5-15-6-10/h4-6,12-14H,1-3H3
InChIKeyNUJPNYQFYRHKBK-UHFFFAOYSA-N
XLogP2.61
TPSA49.16 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of furan-3-yl-(3,4,5-trimethyl-1H-pyrrol-2-yl)methanol?
The IUPAC name of furan-3-yl-(3,4,5-trimethyl-1H-pyrrol-2-yl)methanol (CID 63927081) is furan-3-yl-(3,4,5-trimethyl-1H-pyrrol-2-yl)methanol.
What is the SMILES notation for furan-3-yl-(3,4,5-trimethyl-1H-pyrrol-2-yl)methanol?
The canonical SMILES for furan-3-yl-(3,4,5-trimethyl-1H-pyrrol-2-yl)methanol is Cc1[nH]c(C(O)c2ccoc2)c(C)c1C.
What is the InChIKey of furan-3-yl-(3,4,5-trimethyl-1H-pyrrol-2-yl)methanol?
The InChIKey is NUJPNYQFYRHKBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO2/c1-7-8(2)11(13-9(7)3)12(14)10-4-5-15-6-10/h4-6,12-14H,1-3H3.
What are the key properties of furan-3-yl-(3,4,5-trimethyl-1H-pyrrol-2-yl)methanol?
furan-3-yl-(3,4,5-trimethyl-1H-pyrrol-2-yl)methanol has a molecular weight of 205.26 g/mol, XLogP of 2.61, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for furan-3-yl-(3,4,5-trimethyl-1H-pyrrol-2-yl)methanol is sourced from PubChem (CID 63927081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).