4-[(3-methoxy-2-pyridinyl)oxy]butan-1-ol

C10H15NO3 — CID 57264913

IUPAC4-[(3-methoxy-2-pyridinyl)oxy]butan-1-ol
SMILESCOc1cccnc1OCCCCO
InChIInChI=1S/C10H15NO3/c1-13-9-5-4-6-11-10(9)14-8-3-2-7-12/h4-6,12H,2-3,7-8H2,1H3
InChIKeyOFSJVTMHSPINHZ-UHFFFAOYSA-N
MW197.23 g/mol
LogP1.24
Rot. Bonds6

About 4-[(3-methoxy-2-pyridinyl)oxy]butan-1-ol

4-[(3-methoxy-2-pyridinyl)oxy]butan-1-ol (PubChem CID 57264913) has the molecular formula C10H15NO3 and a molecular weight of 197.23 g/mol. Its IUPAC name is 4-[(3-methoxy-2-pyridinyl)oxy]butan-1-ol.

Molecular Properties

Compound Name4-[(3-methoxy-2-pyridinyl)oxy]butan-1-ol
PubChem CID57264913
Molecular FormulaC10H15NO3
Molecular Weight197.23 g/mol
Exact Mass197.11
IUPAC Name4-[(3-methoxy-2-pyridinyl)oxy]butan-1-ol
SMILESCOc1cccnc1OCCCCO
InChIInChI=1S/C10H15NO3/c1-13-9-5-4-6-11-10(9)14-8-3-2-7-12/h4-6,12H,2-3,7-8H2,1H3
InChIKeyOFSJVTMHSPINHZ-UHFFFAOYSA-N
XLogP1.24
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.23
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-(2-methoxyphenoxy)butan-1-ol
CID 43510003
2,3-didecoxypyridine
CID 151922374
6-[(3-methoxy-2-pyridinyl)amino]hexan-1-ol
CID 107848736
5-[(2-amino-3-pyridinyl)oxy]pentan-1-ol
CID 62229508
2,3-bis(4-bromobutoxy)pyridine
CID 139649131
3-[(3-bromo-2-pyridinyl)oxy]propan-1-ol
CID 61375068
[4-[(3-methoxy-2-pyridinyl)oxy]phenyl]methanol
CID 113371155
N-(5-hydroxypentyl)-2-methoxypyridine-3-carboxamide
CID 107318362
(3-methoxy-2-pyridinyl) hydrogen carbonate;hydrochloride
CID 22363173
3-methoxy-2-(oxiran-2-ylmethoxy)pyridine
CID 13195077
2-(2-methoxyphenoxy)pyridine-3-carbothioamide
CID 24702703
15-[2-(15-hydroxypentadecoxy)phenoxy]pentadecan-1-ol
CID 139621951

Frequently Asked Questions

What is the IUPAC name of 4-[(3-methoxy-2-pyridinyl)oxy]butan-1-ol?
The IUPAC name of 4-[(3-methoxy-2-pyridinyl)oxy]butan-1-ol (CID 57264913) is 4-[(3-methoxy-2-pyridinyl)oxy]butan-1-ol.
What is the SMILES notation for 4-[(3-methoxy-2-pyridinyl)oxy]butan-1-ol?
The canonical SMILES for 4-[(3-methoxy-2-pyridinyl)oxy]butan-1-ol is COc1cccnc1OCCCCO.
What is the InChIKey of 4-[(3-methoxy-2-pyridinyl)oxy]butan-1-ol?
The InChIKey is OFSJVTMHSPINHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO3/c1-13-9-5-4-6-11-10(9)14-8-3-2-7-12/h4-6,12H,2-3,7-8H2,1H3.
What are the key properties of 4-[(3-methoxy-2-pyridinyl)oxy]butan-1-ol?
4-[(3-methoxy-2-pyridinyl)oxy]butan-1-ol has a molecular weight of 197.23 g/mol, XLogP of 1.24, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-methoxy-2-pyridinyl)oxy]butan-1-ol is sourced from PubChem (CID 57264913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).