(1R)-1,5,8-trimethyl-1,2-dihydroazuleno[6,5-b]furan

C15H16O — CID 162847530

IUPAC(1R)-1,5,8-trimethyl-1,2-dihydroazuleno[6,5-b]furan
SMILESCc1cc2c(cc3c(C)ccc1-3)[C@@H](C)CO2
InChIInChI=1S/C15H16O/c1-9-4-5-12-10(2)6-15-14(7-13(9)12)11(3)8-16-15/h4-7,11H,8H2,1-3H3/t11-/m0/s1
InChIKeyZJOMESPFVPWXSI-NSHDSACASA-N
MW212.29 g/mol
LogP3.90
Rot. Bonds

About (1R)-1,5,8-trimethyl-1,2-dihydroazuleno[6,5-b]furan

(1R)-1,5,8-trimethyl-1,2-dihydroazuleno[6,5-b]furan (PubChem CID 162847530) has the molecular formula C15H16O and a molecular weight of 212.29 g/mol. Its IUPAC name is (1R)-1,5,8-trimethyl-1,2-dihydroazuleno[6,5-b]furan.

Molecular Properties

Compound Name(1R)-1,5,8-trimethyl-1,2-dihydroazuleno[6,5-b]furan
PubChem CID162847530
Molecular FormulaC15H16O
Molecular Weight212.29 g/mol
Exact Mass212.12
IUPAC Name(1R)-1,5,8-trimethyl-1,2-dihydroazuleno[6,5-b]furan
SMILESCc1cc2c(cc3c(C)ccc1-3)[C@@H](C)CO2
InChIInChI=1S/C15H16O/c1-9-4-5-12-10(2)6-15-14(7-13(9)12)11(3)8-16-15/h4-7,11H,8H2,1-3H3/t11-/m0/s1
InChIKeyZJOMESPFVPWXSI-NSHDSACASA-N
XLogP3.90
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1R)-1,5,8-trimethyl-1,2-dihydroazuleno[6,5-b]furan?
The IUPAC name of (1R)-1,5,8-trimethyl-1,2-dihydroazuleno[6,5-b]furan (CID 162847530) is (1R)-1,5,8-trimethyl-1,2-dihydroazuleno[6,5-b]furan.
What is the SMILES notation for (1R)-1,5,8-trimethyl-1,2-dihydroazuleno[6,5-b]furan?
The canonical SMILES for (1R)-1,5,8-trimethyl-1,2-dihydroazuleno[6,5-b]furan is Cc1cc2c(cc3c(C)ccc1-3)[C@@H](C)CO2.
What is the InChIKey of (1R)-1,5,8-trimethyl-1,2-dihydroazuleno[6,5-b]furan?
The InChIKey is ZJOMESPFVPWXSI-NSHDSACASA-N. The full InChI is InChI=1S/C15H16O/c1-9-4-5-12-10(2)6-15-14(7-13(9)12)11(3)8-16-15/h4-7,11H,8H2,1-3H3/t11-/m0/s1.
What are the key properties of (1R)-1,5,8-trimethyl-1,2-dihydroazuleno[6,5-b]furan?
(1R)-1,5,8-trimethyl-1,2-dihydroazuleno[6,5-b]furan has a molecular weight of 212.29 g/mol, XLogP of 3.90, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1,5,8-trimethyl-1,2-dihydroazuleno[6,5-b]furan is sourced from PubChem (CID 162847530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).