6-(4-phenylmethoxyphenoxy)pyridine-3-carbaldehyde

C19H15NO3 — CID 172879447

IUPAC6-(4-phenylmethoxyphenoxy)pyridine-3-carbaldehyde
SMILESO=Cc1ccc(Oc2ccc(OCc3ccccc3)cc2)nc1
InChIInChI=1S/C19H15NO3/c21-13-16-6-11-19(20-12-16)23-18-9-7-17(8-10-18)22-14-15-4-2-1-3-5-15/h1-13H,14H2
InChIKeyUNMXZFCNENMWCT-UHFFFAOYSA-N
MW305.33 g/mol
LogP4.27
Rot. Bonds6

About 6-(4-phenylmethoxyphenoxy)pyridine-3-carbaldehyde

6-(4-phenylmethoxyphenoxy)pyridine-3-carbaldehyde (PubChem CID 172879447) has the molecular formula C19H15NO3 and a molecular weight of 305.33 g/mol. Its IUPAC name is 6-(4-phenylmethoxyphenoxy)pyridine-3-carbaldehyde.

Molecular Properties

Compound Name6-(4-phenylmethoxyphenoxy)pyridine-3-carbaldehyde
PubChem CID172879447
Molecular FormulaC19H15NO3
Molecular Weight305.33 g/mol
Exact Mass305.11
IUPAC Name6-(4-phenylmethoxyphenoxy)pyridine-3-carbaldehyde
SMILESO=Cc1ccc(Oc2ccc(OCc3ccccc3)cc2)nc1
InChIInChI=1S/C19H15NO3/c21-13-16-6-11-19(20-12-16)23-18-9-7-17(8-10-18)22-14-15-4-2-1-3-5-15/h1-13H,14H2
InChIKeyUNMXZFCNENMWCT-UHFFFAOYSA-N
XLogP4.27
TPSA48.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.33
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-phenylmethoxypyridine-3-carbaldehyde
CID 21102205
6-(4-ethylphenoxy)pyridine-3-carbaldehyde
CID 80631614
6-(4-iodophenoxy)pyridine-3-carbaldehyde
CID 80632740
5-ethynyl-2-(4-phenylmethoxyphenoxy)pyridine
CID 172879468
6-(4-propan-2-ylphenoxy)pyridine-3-carbaldehyde
CID 80632252
6-[(4-methoxyphenyl)methoxy]pyridine-3-carbaldehyde
CID 80632122
6-[4-(2-methoxyethyl)phenoxy]pyridine-3-carbaldehyde
CID 80631991
6-(4-cyclopropylphenoxy)pyridine-3-carbaldehyde
CID 118113115
4-[[3-[(4-formylphenoxy)methyl]phenyl]methoxy]benzaldehyde
CID 19038438
ethyl propanoate;4-[(5-phenylmethoxy-2-pyridinyl)oxy]phenol
CID 167499413
(2Z,3Z)-2,3-bis[(4-phenylmethoxyphenyl)methylidene]butanedial
CID 11248500
acetamido 2-[6-(4-phenylmethoxyphenoxy)-3-pyridinyl]acetate
CID 139794426

Frequently Asked Questions

What is the IUPAC name of 6-(4-phenylmethoxyphenoxy)pyridine-3-carbaldehyde?
The IUPAC name of 6-(4-phenylmethoxyphenoxy)pyridine-3-carbaldehyde (CID 172879447) is 6-(4-phenylmethoxyphenoxy)pyridine-3-carbaldehyde.
What is the SMILES notation for 6-(4-phenylmethoxyphenoxy)pyridine-3-carbaldehyde?
The canonical SMILES for 6-(4-phenylmethoxyphenoxy)pyridine-3-carbaldehyde is O=Cc1ccc(Oc2ccc(OCc3ccccc3)cc2)nc1.
What is the InChIKey of 6-(4-phenylmethoxyphenoxy)pyridine-3-carbaldehyde?
The InChIKey is UNMXZFCNENMWCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15NO3/c21-13-16-6-11-19(20-12-16)23-18-9-7-17(8-10-18)22-14-15-4-2-1-3-5-15/h1-13H,14H2.
What are the key properties of 6-(4-phenylmethoxyphenoxy)pyridine-3-carbaldehyde?
6-(4-phenylmethoxyphenoxy)pyridine-3-carbaldehyde has a molecular weight of 305.33 g/mol, XLogP of 4.27, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-phenylmethoxyphenoxy)pyridine-3-carbaldehyde is sourced from PubChem (CID 172879447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).