1-(furan-3-yl)nonadecan-1-ol

C23H42O2 — CID 10712867

IUPAC1-(furan-3-yl)nonadecan-1-ol
SMILESCCCCCCCCCCCCCCCCCCC(O)c1ccoc1
InChIInChI=1S/C23H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(24)22-19-20-25-21-22/h19-21,23-24H,2-18H2,1H3
InChIKeyBTETXRBUKOGXQT-UHFFFAOYSA-N
MW350.59 g/mol
LogP7.96
Rot. Bonds18

About 1-(furan-3-yl)nonadecan-1-ol

1-(furan-3-yl)nonadecan-1-ol (PubChem CID 10712867) has the molecular formula C23H42O2 and a molecular weight of 350.59 g/mol. Its IUPAC name is 1-(furan-3-yl)nonadecan-1-ol.

Molecular Properties

Compound Name1-(furan-3-yl)nonadecan-1-ol
PubChem CID10712867
Molecular FormulaC23H42O2
Molecular Weight350.59 g/mol
Exact Mass350.32
IUPAC Name1-(furan-3-yl)nonadecan-1-ol
SMILESCCCCCCCCCCCCCCCCCCC(O)c1ccoc1
InChIInChI=1S/C23H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(24)22-19-20-25-21-22/h19-21,23-24H,2-18H2,1H3
InChIKeyBTETXRBUKOGXQT-UHFFFAOYSA-N
XLogP7.96
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds18
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500350.59
LogP ≤ 57.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-(furan-3-yl)nonadecan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1S)-1-(furan-3-yl)butane-1,4-diol
CID 129362358
4-chloro-1-(furan-3-yl)butan-1-ol
CID 66045175
(1R)-3-chloro-1-(furan-3-yl)propan-1-ol
CID 55298538
2-ethyl-1-(furan-3-yl)hexan-1-ol
CID 115797249
(1R)-1-phenyloctan-1-ol
CID 12794259
4,4,4-trifluoro-1-(furan-3-yl)butan-1-ol
CID 64567375
4-(1-hydroxytridecyl)phenol
CID 57120972
(1R)-1-(4-chlorophenyl)heptan-1-ol
CID 94505087
1-pyridin-4-yltridecan-1-ol
CID 63410309
(1R)-1-(4-chlorophenyl)undecan-1-ol
CID 98483140
(1S)-1-(4-bromophenyl)octan-1-ol
CID 124554353
1-(4-fluorophenyl)dodecan-1-ol
CID 65426373

Frequently Asked Questions

What is the IUPAC name of 1-(furan-3-yl)nonadecan-1-ol?
The IUPAC name of 1-(furan-3-yl)nonadecan-1-ol (CID 10712867) is 1-(furan-3-yl)nonadecan-1-ol.
What is the SMILES notation for 1-(furan-3-yl)nonadecan-1-ol?
The canonical SMILES for 1-(furan-3-yl)nonadecan-1-ol is CCCCCCCCCCCCCCCCCCC(O)c1ccoc1.
What is the InChIKey of 1-(furan-3-yl)nonadecan-1-ol?
The InChIKey is BTETXRBUKOGXQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(24)22-19-20-25-21-22/h19-21,23-24H,2-18H2,1H3.
What are the key properties of 1-(furan-3-yl)nonadecan-1-ol?
1-(furan-3-yl)nonadecan-1-ol has a molecular weight of 350.59 g/mol, XLogP of 7.96, 18 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-3-yl)nonadecan-1-ol is sourced from PubChem (CID 10712867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).