N-cyclopropyl-5-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide

C15H15N3O2 — CID 117086611

IUPACN-cyclopropyl-5-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide
SMILESCOc1ccc(-c2cncc(C(=O)NC3CC3)c2)cn1
InChIInChI=1S/C15H15N3O2/c1-20-14-5-2-10(9-17-14)11-6-12(8-16-7-11)15(19)18-13-3-4-13/h2,5-9,13H,3-4H2,1H3,(H,18,19)
InChIKeyXXXYJMJGQQAOEB-UHFFFAOYSA-N
MW269.30 g/mol
LogP2.04
Rot. Bonds4

About N-cyclopropyl-5-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide

N-cyclopropyl-5-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide (PubChem CID 117086611) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is N-cyclopropyl-5-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide
PubChem CID117086611
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC NameN-cyclopropyl-5-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide
SMILESCOc1ccc(-c2cncc(C(=O)NC3CC3)c2)cn1
InChIInChI=1S/C15H15N3O2/c1-20-14-5-2-10(9-17-14)11-6-12(8-16-7-11)15(19)18-13-3-4-13/h2,5-9,13H,3-4H2,1H3,(H,18,19)
InChIKeyXXXYJMJGQQAOEB-UHFFFAOYSA-N
XLogP2.04
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide?
The IUPAC name of N-cyclopropyl-5-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide (CID 117086611) is N-cyclopropyl-5-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-5-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide is COc1ccc(-c2cncc(C(=O)NC3CC3)c2)cn1.
What is the InChIKey of N-cyclopropyl-5-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide?
The InChIKey is XXXYJMJGQQAOEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2/c1-20-14-5-2-10(9-17-14)11-6-12(8-16-7-11)15(19)18-13-3-4-13/h2,5-9,13H,3-4H2,1H3,(H,18,19).
What are the key properties of N-cyclopropyl-5-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide?
N-cyclopropyl-5-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide has a molecular weight of 269.30 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide is sourced from PubChem (CID 117086611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).