6-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide

C14H15N3O2 — CID 112722816

IUPAC6-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide
SMILESCOc1ccccc1CNc1ccc(C(N)=O)cn1
InChIInChI=1S/C14H15N3O2/c1-19-12-5-3-2-4-10(12)8-16-13-7-6-11(9-17-13)14(15)18/h2-7,9H,8H2,1H3,(H2,15,18)(H,16,17)
InChIKeyOZFDPNFXJQTLGG-UHFFFAOYSA-N
MW257.29 g/mol
LogP1.80
Rot. Bonds5

About 6-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide

6-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide (PubChem CID 112722816) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is 6-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide
PubChem CID112722816
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC Name6-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide
SMILESCOc1ccccc1CNc1ccc(C(N)=O)cn1
InChIInChI=1S/C14H15N3O2/c1-19-12-5-3-2-4-10(12)8-16-13-7-6-11(9-17-13)14(15)18/h2-7,9H,8H2,1H3,(H2,15,18)(H,16,17)
InChIKeyOZFDPNFXJQTLGG-UHFFFAOYSA-N
XLogP1.80
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide?
The IUPAC name of 6-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide (CID 112722816) is 6-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide.
What is the SMILES notation for 6-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide?
The canonical SMILES for 6-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide is COc1ccccc1CNc1ccc(C(N)=O)cn1.
What is the InChIKey of 6-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide?
The InChIKey is OZFDPNFXJQTLGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-19-12-5-3-2-4-10(12)8-16-13-7-6-11(9-17-13)14(15)18/h2-7,9H,8H2,1H3,(H2,15,18)(H,16,17).
What are the key properties of 6-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide?
6-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 1.80, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide is sourced from PubChem (CID 112722816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).