N-[4-[5-(hydroxymethyl)furan-2-yl]phenyl]pyridine-3-carboxamide

C17H14N2O3 — CID 28675230

IUPACN-[4-[5-(hydroxymethyl)furan-2-yl]phenyl]pyridine-3-carboxamide
SMILESO=C(Nc1ccc(-c2ccc(CO)o2)cc1)c1cccnc1
InChIInChI=1S/C17H14N2O3/c20-11-15-7-8-16(22-15)12-3-5-14(6-4-12)19-17(21)13-2-1-9-18-10-13/h1-10,20H,11H2,(H,19,21)
InChIKeyOXUGZKHPWXWTFI-UHFFFAOYSA-N
MW294.31 g/mol
LogP3.09
Rot. Bonds4

About N-[4-[5-(hydroxymethyl)furan-2-yl]phenyl]pyridine-3-carboxamide

N-[4-[5-(hydroxymethyl)furan-2-yl]phenyl]pyridine-3-carboxamide (PubChem CID 28675230) has the molecular formula C17H14N2O3 and a molecular weight of 294.31 g/mol. Its IUPAC name is N-[4-[5-(hydroxymethyl)furan-2-yl]phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[4-[5-(hydroxymethyl)furan-2-yl]phenyl]pyridine-3-carboxamide
PubChem CID28675230
Molecular FormulaC17H14N2O3
Molecular Weight294.31 g/mol
Exact Mass294.10
IUPAC NameN-[4-[5-(hydroxymethyl)furan-2-yl]phenyl]pyridine-3-carboxamide
SMILESO=C(Nc1ccc(-c2ccc(CO)o2)cc1)c1cccnc1
InChIInChI=1S/C17H14N2O3/c20-11-15-7-8-16(22-15)12-3-5-14(6-4-12)19-17(21)13-2-1-9-18-10-13/h1-10,20H,11H2,(H,19,21)
InChIKeyOXUGZKHPWXWTFI-UHFFFAOYSA-N
XLogP3.09
TPSA75.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(furan-2-yl)phenyl]pyridine-3-carboxamide
CID 168526932
N-[3-[[5-(4-chlorophenyl)furan-2-yl]methylcarbamoyl]phenyl]pyridine-3-carboxamide
CID 46410027
N-[4-[5-(hydroxymethyl)furan-2-yl]phenyl]-3-phenylmethoxybenzamide
CID 28677528
N-[4-(2-cyclopropyl-1,3-oxazol-5-yl)phenyl]pyridine-3-carboxamide
CID 33196301
N-(4-acetamidophenyl)pyridine-3-carboxamide
CID 766053
N-[4-[5-(hydroxymethyl)furan-2-yl]phenyl]naphthalene-1-carboxamide
CID 28668494
N-[4-[5-(hydroxymethyl)furan-2-yl]phenyl]-2,2-diphenylacetamide
CID 28666297
N'-[3-(5-phenylfuran-2-yl)propanoyl]pyridine-3-carbohydrazide
CID 51157515
3,4,5-triethoxy-N-[4-[5-(hydroxymethyl)furan-2-yl]phenyl]benzamide
CID 28675160
N-(4-fluorophenyl)pyridine-3-carboxamide;hydrochloride
CID 110756411
N-[4-(1,3-benzoxazol-2-yl)phenyl]pyridine-3-carboxamide
CID 778969
N-[[5-(4-chlorophenyl)furan-2-yl]methylcarbamothioyl]pyridine-3-carboxamide
CID 54860373

Frequently Asked Questions

What is the IUPAC name of N-[4-[5-(hydroxymethyl)furan-2-yl]phenyl]pyridine-3-carboxamide?
The IUPAC name of N-[4-[5-(hydroxymethyl)furan-2-yl]phenyl]pyridine-3-carboxamide (CID 28675230) is N-[4-[5-(hydroxymethyl)furan-2-yl]phenyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[4-[5-(hydroxymethyl)furan-2-yl]phenyl]pyridine-3-carboxamide?
The canonical SMILES for N-[4-[5-(hydroxymethyl)furan-2-yl]phenyl]pyridine-3-carboxamide is O=C(Nc1ccc(-c2ccc(CO)o2)cc1)c1cccnc1.
What is the InChIKey of N-[4-[5-(hydroxymethyl)furan-2-yl]phenyl]pyridine-3-carboxamide?
The InChIKey is OXUGZKHPWXWTFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O3/c20-11-15-7-8-16(22-15)12-3-5-14(6-4-12)19-17(21)13-2-1-9-18-10-13/h1-10,20H,11H2,(H,19,21).
What are the key properties of N-[4-[5-(hydroxymethyl)furan-2-yl]phenyl]pyridine-3-carboxamide?
N-[4-[5-(hydroxymethyl)furan-2-yl]phenyl]pyridine-3-carboxamide has a molecular weight of 294.31 g/mol, XLogP of 3.09, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[5-(hydroxymethyl)furan-2-yl]phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 28675230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).