7-[3-(morpholin-4-ylmethyl)phenyl]furo[3,2-c]pyridine-2-carbaldehyde

C19H18N2O3 — CID 118089280

IUPAC7-[3-(morpholin-4-ylmethyl)phenyl]furo[3,2-c]pyridine-2-carbaldehyde
SMILESO=Cc1cc2cncc(-c3cccc(CN4CCOCC4)c3)c2o1
InChIInChI=1S/C19H18N2O3/c22-13-17-9-16-10-20-11-18(19(16)24-17)15-3-1-2-14(8-15)12-21-4-6-23-7-5-21/h1-3,8-11,13H,4-7,12H2
InChIKeyIATPIHIWZAHBMS-UHFFFAOYSA-N
MW322.36 g/mol
LogP3.14
Rot. Bonds4

About 7-[3-(morpholin-4-ylmethyl)phenyl]furo[3,2-c]pyridine-2-carbaldehyde

7-[3-(morpholin-4-ylmethyl)phenyl]furo[3,2-c]pyridine-2-carbaldehyde (PubChem CID 118089280) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is 7-[3-(morpholin-4-ylmethyl)phenyl]furo[3,2-c]pyridine-2-carbaldehyde.

Molecular Properties

Compound Name7-[3-(morpholin-4-ylmethyl)phenyl]furo[3,2-c]pyridine-2-carbaldehyde
PubChem CID118089280
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC Name7-[3-(morpholin-4-ylmethyl)phenyl]furo[3,2-c]pyridine-2-carbaldehyde
SMILESO=Cc1cc2cncc(-c3cccc(CN4CCOCC4)c3)c2o1
InChIInChI=1S/C19H18N2O3/c22-13-17-9-16-10-20-11-18(19(16)24-17)15-3-1-2-14(8-15)12-21-4-6-23-7-5-21/h1-3,8-11,13H,4-7,12H2
InChIKeyIATPIHIWZAHBMS-UHFFFAOYSA-N
XLogP3.14
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 7-[3-(morpholin-4-ylmethyl)phenyl]furo[3,2-c]pyridine-2-carbaldehyde?
The IUPAC name of 7-[3-(morpholin-4-ylmethyl)phenyl]furo[3,2-c]pyridine-2-carbaldehyde (CID 118089280) is 7-[3-(morpholin-4-ylmethyl)phenyl]furo[3,2-c]pyridine-2-carbaldehyde.
What is the SMILES notation for 7-[3-(morpholin-4-ylmethyl)phenyl]furo[3,2-c]pyridine-2-carbaldehyde?
The canonical SMILES for 7-[3-(morpholin-4-ylmethyl)phenyl]furo[3,2-c]pyridine-2-carbaldehyde is O=Cc1cc2cncc(-c3cccc(CN4CCOCC4)c3)c2o1.
What is the InChIKey of 7-[3-(morpholin-4-ylmethyl)phenyl]furo[3,2-c]pyridine-2-carbaldehyde?
The InChIKey is IATPIHIWZAHBMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3/c22-13-17-9-16-10-20-11-18(19(16)24-17)15-3-1-2-14(8-15)12-21-4-6-23-7-5-21/h1-3,8-11,13H,4-7,12H2.
What are the key properties of 7-[3-(morpholin-4-ylmethyl)phenyl]furo[3,2-c]pyridine-2-carbaldehyde?
7-[3-(morpholin-4-ylmethyl)phenyl]furo[3,2-c]pyridine-2-carbaldehyde has a molecular weight of 322.36 g/mol, XLogP of 3.14, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[3-(morpholin-4-ylmethyl)phenyl]furo[3,2-c]pyridine-2-carbaldehyde is sourced from PubChem (CID 118089280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).