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

C15H16N2O3 — CID 63310970

IUPACN-[[3-(hydroxymethyl)phenyl]methyl]-6-methoxypyridine-3-carboxamide
SMILESCOc1ccc(C(=O)NCc2cccc(CO)c2)cn1
InChIInChI=1S/C15H16N2O3/c1-20-14-6-5-13(9-16-14)15(19)17-8-11-3-2-4-12(7-11)10-18/h2-7,9,18H,8,10H2,1H3,(H,17,19)
InChIKeyFNVXPOMHNRDEML-UHFFFAOYSA-N
MW272.30 g/mol
LogP1.51
Rot. Bonds5

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

N-[[3-(hydroxymethyl)phenyl]methyl]-6-methoxypyridine-3-carboxamide (PubChem CID 63310970) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is N-[[3-(hydroxymethyl)phenyl]methyl]-6-methoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-[[3-(hydroxymethyl)phenyl]methyl]-6-methoxypyridine-3-carboxamide
PubChem CID63310970
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC NameN-[[3-(hydroxymethyl)phenyl]methyl]-6-methoxypyridine-3-carboxamide
SMILESCOc1ccc(C(=O)NCc2cccc(CO)c2)cn1
InChIInChI=1S/C15H16N2O3/c1-20-14-6-5-13(9-16-14)15(19)17-8-11-3-2-4-12(7-11)10-18/h2-7,9,18H,8,10H2,1H3,(H,17,19)
InChIKeyFNVXPOMHNRDEML-UHFFFAOYSA-N
XLogP1.51
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-methoxy-N-[[3-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxamide
CID 27009221
N-[3-(hydroxymethyl)phenyl]-6-methoxypyridine-3-carboxamide
CID 60698682
1-N,4-N-bis[(6-methoxy-3-pyridinyl)methyl]benzene-1,4-dicarboxamide
CID 24646071
3-hydroxy-N-[[3-(hydroxymethyl)phenyl]methyl]-4-methoxybenzamide
CID 79589957
6-amino-N-[(6-methoxy-3-pyridinyl)methyl]pyridine-3-carboxamide
CID 55152846
3-amino-N-[[3-(hydroxymethyl)phenyl]methyl]-4-methoxybenzamide
CID 107210223
6-ethoxy-N-[[3-[[ethyl(methyl)amino]methyl]phenyl]methyl]pyridine-3-carboxamide
CID 86849292
5,6-dichloro-N-[[3-(hydroxymethyl)phenyl]methyl]pyridine-3-carboxamide
CID 63311124
N-[[3-[[(3,4-dimethoxybenzoyl)amino]methyl]phenyl]methyl]-3,4-dimethoxybenzamide
CID 2841934
N-[[3-(hydroxymethyl)phenyl]methyl]-3,5-dimethylbenzamide
CID 63311041
4-methoxy-N-[[3-[[(4-methoxybenzoyl)amino]methyl]phenyl]methyl]benzamide
CID 4118576
4-hydroxy-N-[[3-(hydroxymethyl)phenyl]methyl]benzamide
CID 63311474

Frequently Asked Questions

What is the IUPAC name of N-[[3-(hydroxymethyl)phenyl]methyl]-6-methoxypyridine-3-carboxamide?
The IUPAC name of N-[[3-(hydroxymethyl)phenyl]methyl]-6-methoxypyridine-3-carboxamide (CID 63310970) is N-[[3-(hydroxymethyl)phenyl]methyl]-6-methoxypyridine-3-carboxamide.
What is the SMILES notation for N-[[3-(hydroxymethyl)phenyl]methyl]-6-methoxypyridine-3-carboxamide?
The canonical SMILES for N-[[3-(hydroxymethyl)phenyl]methyl]-6-methoxypyridine-3-carboxamide is COc1ccc(C(=O)NCc2cccc(CO)c2)cn1.
What is the InChIKey of N-[[3-(hydroxymethyl)phenyl]methyl]-6-methoxypyridine-3-carboxamide?
The InChIKey is FNVXPOMHNRDEML-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c1-20-14-6-5-13(9-16-14)15(19)17-8-11-3-2-4-12(7-11)10-18/h2-7,9,18H,8,10H2,1H3,(H,17,19).
What are the key properties of N-[[3-(hydroxymethyl)phenyl]methyl]-6-methoxypyridine-3-carboxamide?
N-[[3-(hydroxymethyl)phenyl]methyl]-6-methoxypyridine-3-carboxamide has a molecular weight of 272.30 g/mol, XLogP of 1.51, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(hydroxymethyl)phenyl]methyl]-6-methoxypyridine-3-carboxamide is sourced from PubChem (CID 63310970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).