2-fluoro-N-[4-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide

C15H15FN2O3 — CID 61295120

IUPAC2-fluoro-N-[4-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide
SMILESCOCCOc1ccc(NC(=O)c2ccnc(F)c2)cc1
InChIInChI=1S/C15H15FN2O3/c1-20-8-9-21-13-4-2-12(3-5-13)18-15(19)11-6-7-17-14(16)10-11/h2-7,10H,8-9H2,1H3,(H,18,19)
InChIKeySMTSKDUMPUXTCI-UHFFFAOYSA-N
MW290.29 g/mol
LogP2.50
Rot. Bonds6

About 2-fluoro-N-[4-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide

2-fluoro-N-[4-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide (PubChem CID 61295120) has the molecular formula C15H15FN2O3 and a molecular weight of 290.29 g/mol. Its IUPAC name is 2-fluoro-N-[4-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-fluoro-N-[4-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide
PubChem CID61295120
Molecular FormulaC15H15FN2O3
Molecular Weight290.29 g/mol
Exact Mass290.11
IUPAC Name2-fluoro-N-[4-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide
SMILESCOCCOc1ccc(NC(=O)c2ccnc(F)c2)cc1
InChIInChI=1S/C15H15FN2O3/c1-20-8-9-21-13-4-2-12(3-5-13)18-15(19)11-6-7-17-14(16)10-11/h2-7,10H,8-9H2,1H3,(H,18,19)
InChIKeySMTSKDUMPUXTCI-UHFFFAOYSA-N
XLogP2.50
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.29
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-fluoro-N-(4-methoxyphenyl)pyridine-4-carboxamide
CID 61293421
methyl 4-[(2-fluoropyridine-4-carbonyl)amino]benzoate
CID 61292895
4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide
CID 15943272
2-fluoro-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]pyridine-4-carboxamide
CID 61294942
2-fluoro-N-[4-[(R)-methylsulfinyl]phenyl]pyridine-4-carboxamide
CID 96565912
N-(4-fluorophenyl)-2-[2-(4-methoxyphenoxy)ethylamino]pyridine-4-carboxamide
CID 109174963
N-(4-butylphenyl)-2-fluoropyridine-4-carboxamide
CID 61294537
methyl 4-[[4-(2-methoxyethoxy)phenyl]carbamoyl]benzoate
CID 17178280
N-(3,4-difluorophenyl)-2-fluoropyridine-4-carboxamide
CID 61295443
4-fluoro-N-[4-[2-[4-[(4-fluorobenzoyl)amino]phenoxy]ethoxy]phenyl]benzamide
CID 17386974
2-(aminomethyl)-N-(4-ethoxyphenyl)pyridine-4-carboxamide
CID 114325480
3-(dimethylamino)-N-[4-(2-methoxyethoxy)phenyl]benzamide
CID 46437083

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[4-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide?
The IUPAC name of 2-fluoro-N-[4-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide (CID 61295120) is 2-fluoro-N-[4-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-fluoro-N-[4-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide?
The canonical SMILES for 2-fluoro-N-[4-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide is COCCOc1ccc(NC(=O)c2ccnc(F)c2)cc1.
What is the InChIKey of 2-fluoro-N-[4-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide?
The InChIKey is SMTSKDUMPUXTCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O3/c1-20-8-9-21-13-4-2-12(3-5-13)18-15(19)11-6-7-17-14(16)10-11/h2-7,10H,8-9H2,1H3,(H,18,19).
What are the key properties of 2-fluoro-N-[4-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide?
2-fluoro-N-[4-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide has a molecular weight of 290.29 g/mol, XLogP of 2.50, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[4-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide is sourced from PubChem (CID 61295120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).