N-[3-(hydroxymethyl)phenyl]-6-methoxypyridine-3-carboxamide

C14H14N2O3 — CID 60698682

IUPACN-[3-(hydroxymethyl)phenyl]-6-methoxypyridine-3-carboxamide
SMILESCOc1ccc(C(=O)Nc2cccc(CO)c2)cn1
InChIInChI=1S/C14H14N2O3/c1-19-13-6-5-11(8-15-13)14(18)16-12-4-2-3-10(7-12)9-17/h2-8,17H,9H2,1H3,(H,16,18)
InChIKeyVGDKFZILRZWLIN-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.83
Rot. Bonds4

About N-[3-(hydroxymethyl)phenyl]-6-methoxypyridine-3-carboxamide

N-[3-(hydroxymethyl)phenyl]-6-methoxypyridine-3-carboxamide (PubChem CID 60698682) has the molecular formula C14H14N2O3 and a molecular weight of 258.28 g/mol. Its IUPAC name is N-[3-(hydroxymethyl)phenyl]-6-methoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-(hydroxymethyl)phenyl]-6-methoxypyridine-3-carboxamide
PubChem CID60698682
Molecular FormulaC14H14N2O3
Molecular Weight258.28 g/mol
Exact Mass258.10
IUPAC NameN-[3-(hydroxymethyl)phenyl]-6-methoxypyridine-3-carboxamide
SMILESCOc1ccc(C(=O)Nc2cccc(CO)c2)cn1
InChIInChI=1S/C14H14N2O3/c1-19-13-6-5-11(8-15-13)14(18)16-12-4-2-3-10(7-12)9-17/h2-8,17H,9H2,1H3,(H,16,18)
InChIKeyVGDKFZILRZWLIN-UHFFFAOYSA-N
XLogP1.83
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[3-(hydroxymethyl)phenyl]methyl]-6-methoxypyridine-3-carboxamide
CID 63310970
6-methoxy-N-phenylpyridine-3-carboxamide
CID 44512975
N-[4-(2-hydroxyethyl)phenyl]-6-methoxypyridine-3-carboxamide
CID 61221260
N-[3-[[4-(cyclohexylcarbamoyl)piperidin-1-yl]methyl]phenyl]-6-methoxypyridine-3-carboxamide
CID 72704841
N-[3-(hydroxymethyl)phenyl]-4-methoxy-3-tetradecoxybenzamide
CID 10050364
N-(3-ethylphenyl)-2-methoxypyrimidine-5-carboxamide
CID 139482087
6-amino-N-[3-(methoxymethyl)phenyl]pyridine-3-carboxamide
CID 62060991
4-[(6-methoxypyridine-3-carbonyl)amino]pyridine-2-carboxylic acid
CID 63650775
N-(3-fluorophenyl)-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide
CID 58368181
(6-methoxy-3-pyridinyl)methanol;methyl 6-methoxypyridine-3-carboxylate
CID 158477481
6-methoxy-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)pyridine-3-carboxamide
CID 27033587
ethyl N-[3-[(6-methoxy-3-pyridinyl)carbamoyl]phenyl]carbamate
CID 9210948

Frequently Asked Questions

What is the IUPAC name of N-[3-(hydroxymethyl)phenyl]-6-methoxypyridine-3-carboxamide?
The IUPAC name of N-[3-(hydroxymethyl)phenyl]-6-methoxypyridine-3-carboxamide (CID 60698682) is N-[3-(hydroxymethyl)phenyl]-6-methoxypyridine-3-carboxamide.
What is the SMILES notation for N-[3-(hydroxymethyl)phenyl]-6-methoxypyridine-3-carboxamide?
The canonical SMILES for N-[3-(hydroxymethyl)phenyl]-6-methoxypyridine-3-carboxamide is COc1ccc(C(=O)Nc2cccc(CO)c2)cn1.
What is the InChIKey of N-[3-(hydroxymethyl)phenyl]-6-methoxypyridine-3-carboxamide?
The InChIKey is VGDKFZILRZWLIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3/c1-19-13-6-5-11(8-15-13)14(18)16-12-4-2-3-10(7-12)9-17/h2-8,17H,9H2,1H3,(H,16,18).
What are the key properties of N-[3-(hydroxymethyl)phenyl]-6-methoxypyridine-3-carboxamide?
N-[3-(hydroxymethyl)phenyl]-6-methoxypyridine-3-carboxamide has a molecular weight of 258.28 g/mol, XLogP of 1.83, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(hydroxymethyl)phenyl]-6-methoxypyridine-3-carboxamide is sourced from PubChem (CID 60698682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).