N-methyl-5-phenylmethoxypyridine-3-carboxamide

C14H14N2O2 — CID 123214761

IUPACN-methyl-5-phenylmethoxypyridine-3-carboxamide
SMILESCNC(=O)c1cncc(OCc2ccccc2)c1
InChIInChI=1S/C14H14N2O2/c1-15-14(17)12-7-13(9-16-8-12)18-10-11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,15,17)
InChIKeyWRYOKVUGIVQUQQ-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.02
Rot. Bonds4

About N-methyl-5-phenylmethoxypyridine-3-carboxamide

N-methyl-5-phenylmethoxypyridine-3-carboxamide (PubChem CID 123214761) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is N-methyl-5-phenylmethoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-5-phenylmethoxypyridine-3-carboxamide
PubChem CID123214761
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC NameN-methyl-5-phenylmethoxypyridine-3-carboxamide
SMILESCNC(=O)c1cncc(OCc2ccccc2)c1
InChIInChI=1S/C14H14N2O2/c1-15-14(17)12-7-13(9-16-8-12)18-10-11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,15,17)
InChIKeyWRYOKVUGIVQUQQ-UHFFFAOYSA-N
XLogP2.02
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-5-phenylmethoxypyridine-3-carboxamide?
The IUPAC name of N-methyl-5-phenylmethoxypyridine-3-carboxamide (CID 123214761) is N-methyl-5-phenylmethoxypyridine-3-carboxamide.
What is the SMILES notation for N-methyl-5-phenylmethoxypyridine-3-carboxamide?
The canonical SMILES for N-methyl-5-phenylmethoxypyridine-3-carboxamide is CNC(=O)c1cncc(OCc2ccccc2)c1.
What is the InChIKey of N-methyl-5-phenylmethoxypyridine-3-carboxamide?
The InChIKey is WRYOKVUGIVQUQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-15-14(17)12-7-13(9-16-8-12)18-10-11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,15,17).
What are the key properties of N-methyl-5-phenylmethoxypyridine-3-carboxamide?
N-methyl-5-phenylmethoxypyridine-3-carboxamide has a molecular weight of 242.28 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-phenylmethoxypyridine-3-carboxamide is sourced from PubChem (CID 123214761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).