1-(3-methoxyoxan-4-yl)propan-1-ol

C9H18O3 — CID 130723846

IUPAC1-(3-methoxyoxan-4-yl)propan-1-ol
SMILESCCC(O)C1CCOCC1OC
InChIInChI=1S/C9H18O3/c1-3-8(10)7-4-5-12-6-9(7)11-2/h7-10H,3-6H2,1-2H3
InChIKeyKBQUSNNLPGYPAT-UHFFFAOYSA-N
MW174.24 g/mol
LogP0.81
Rot. Bonds3

About 1-(3-methoxyoxan-4-yl)propan-1-ol

1-(3-methoxyoxan-4-yl)propan-1-ol (PubChem CID 130723846) has the molecular formula C9H18O3 and a molecular weight of 174.24 g/mol. Its IUPAC name is 1-(3-methoxyoxan-4-yl)propan-1-ol.

Molecular Properties

Compound Name1-(3-methoxyoxan-4-yl)propan-1-ol
PubChem CID130723846
Molecular FormulaC9H18O3
Molecular Weight174.24 g/mol
Exact Mass174.13
IUPAC Name1-(3-methoxyoxan-4-yl)propan-1-ol
SMILESCCC(O)C1CCOCC1OC
InChIInChI=1S/C9H18O3/c1-3-8(10)7-4-5-12-6-9(7)11-2/h7-10H,3-6H2,1-2H3
InChIKeyKBQUSNNLPGYPAT-UHFFFAOYSA-N
XLogP0.81
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.24
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(3-methoxyoxan-4-yl)propan-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

1-(3-methoxyoxan-4-yl)-2-methylpropan-1-amine
CID 131101922
(3R,4S)-4-tert-butyl-2-[2-(3-methoxyoxan-4-yl)propyl]oxan-3-ol
CID 146570273
3-methoxy-4-prop-1-en-2-yloxane
CID 163535676
4-chloro-3-methoxyoxane
CID 130632423
ethane;3-methoxy-4-methyloxane
CID 143656491
3-pentan-3-yloxan-4-ol
CID 106471344
[(3R,4S)-3-methoxyoxan-4-yl]methanamine
CID 67314237
(3S,4R)-3-methoxyoxan-4-amine;hydrochloride
CID 122235837
3-(3,4-dimethoxypyrrolidin-1-yl)-N-ethyloxan-4-amine
CID 103532587
2-(2-ethylcyclohexyl)oxy-1-(oxolan-3-yl)ethanol
CID 104753532
1-(oxepan-4-yl)propan-1-ol
CID 79298601
CID 170573296
CID 170573296

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxyoxan-4-yl)propan-1-ol?
The IUPAC name of 1-(3-methoxyoxan-4-yl)propan-1-ol (CID 130723846) is 1-(3-methoxyoxan-4-yl)propan-1-ol.
What is the SMILES notation for 1-(3-methoxyoxan-4-yl)propan-1-ol?
The canonical SMILES for 1-(3-methoxyoxan-4-yl)propan-1-ol is CCC(O)C1CCOCC1OC.
What is the InChIKey of 1-(3-methoxyoxan-4-yl)propan-1-ol?
The InChIKey is KBQUSNNLPGYPAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O3/c1-3-8(10)7-4-5-12-6-9(7)11-2/h7-10H,3-6H2,1-2H3.
What are the key properties of 1-(3-methoxyoxan-4-yl)propan-1-ol?
1-(3-methoxyoxan-4-yl)propan-1-ol has a molecular weight of 174.24 g/mol, XLogP of 0.81, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxyoxan-4-yl)propan-1-ol is sourced from PubChem (CID 130723846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).