4-cyclobutyloxy-6-methyl-N-pyridin-2-ylpyridine-2-carboxamide

C16H17N3O2 — CID 118612946

IUPAC4-cyclobutyloxy-6-methyl-N-pyridin-2-ylpyridine-2-carboxamide
SMILESCc1cc(OC2CCC2)cc(C(=O)Nc2ccccn2)n1
InChIInChI=1S/C16H17N3O2/c1-11-9-13(21-12-5-4-6-12)10-14(18-11)16(20)19-15-7-2-3-8-17-15/h2-3,7-10,12H,4-6H2,1H3,(H,17,19,20)
InChIKeyQBGHXFSDFNVRQY-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.97
Rot. Bonds4

About 4-cyclobutyloxy-6-methyl-N-pyridin-2-ylpyridine-2-carboxamide

4-cyclobutyloxy-6-methyl-N-pyridin-2-ylpyridine-2-carboxamide (PubChem CID 118612946) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is 4-cyclobutyloxy-6-methyl-N-pyridin-2-ylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-cyclobutyloxy-6-methyl-N-pyridin-2-ylpyridine-2-carboxamide
PubChem CID118612946
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC Name4-cyclobutyloxy-6-methyl-N-pyridin-2-ylpyridine-2-carboxamide
SMILESCc1cc(OC2CCC2)cc(C(=O)Nc2ccccn2)n1
InChIInChI=1S/C16H17N3O2/c1-11-9-13(21-12-5-4-6-12)10-14(18-11)16(20)19-15-7-2-3-8-17-15/h2-3,7-10,12H,4-6H2,1H3,(H,17,19,20)
InChIKeyQBGHXFSDFNVRQY-UHFFFAOYSA-N
XLogP2.97
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Auglurant
CID 60168069
2-PyridinecarboxaMide, N-(5-fluoro-2-pyridinyl)-4-[(5-fluoro-3-pyridinyl)oxy]-6-Methyl-
CID 60197821
4-(Piperidin-4-yloxy)pyridine-2-carboxamide
CID 62344237
N-[4-[4-(6-methoxy-2-pyridinyl)piperazin-1-yl]butyl]pyridine-2-carboxamide
CID 11603119
6-methyl-N-(6-methyl-2-pyridinyl)-4-pyrimidin-5-yloxypyridine-2-carboxamide
CID 60197614
N-(4-fluoro-2-pyridinyl)-6-methyl-4-pyrimidin-5-yloxypyridine-2-carboxamide
CID 60197712
N-(6-fluoro-2-pyridinyl)-6-methyl-4-pyrimidin-5-yloxypyridine-2-carboxamide
CID 60197713
N-(5-fluoro-2-pyridinyl)-6-methyl-4-(2-methylpyrimidin-5-yl)oxypyridine-2-carboxamide
CID 60197716
4-[(5-fluoro-3-pyridinyl)oxy]-6-methyl-N-(6-methyl-2-pyridinyl)pyridine-2-carboxamide
CID 60197822
N-(4-fluoro-2-pyridinyl)-4-[(5-fluoro-3-pyridinyl)oxy]-6-methylpyridine-2-carboxamide
CID 60197823
N-(6-fluoro-2-pyridinyl)-4-[(5-fluoro-3-pyridinyl)oxy]-6-methylpyridine-2-carboxamide
CID 60197825
N-(6-ethyl-2-pyridinyl)-6-methyl-4-pyrimidin-5-yloxypyridine-2-carboxamide
CID 60197937

Frequently Asked Questions

What is the IUPAC name of 4-cyclobutyloxy-6-methyl-N-pyridin-2-ylpyridine-2-carboxamide?
The IUPAC name of 4-cyclobutyloxy-6-methyl-N-pyridin-2-ylpyridine-2-carboxamide (CID 118612946) is 4-cyclobutyloxy-6-methyl-N-pyridin-2-ylpyridine-2-carboxamide.
What is the SMILES notation for 4-cyclobutyloxy-6-methyl-N-pyridin-2-ylpyridine-2-carboxamide?
The canonical SMILES for 4-cyclobutyloxy-6-methyl-N-pyridin-2-ylpyridine-2-carboxamide is Cc1cc(OC2CCC2)cc(C(=O)Nc2ccccn2)n1.
What is the InChIKey of 4-cyclobutyloxy-6-methyl-N-pyridin-2-ylpyridine-2-carboxamide?
The InChIKey is QBGHXFSDFNVRQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c1-11-9-13(21-12-5-4-6-12)10-14(18-11)16(20)19-15-7-2-3-8-17-15/h2-3,7-10,12H,4-6H2,1H3,(H,17,19,20).
What are the key properties of 4-cyclobutyloxy-6-methyl-N-pyridin-2-ylpyridine-2-carboxamide?
4-cyclobutyloxy-6-methyl-N-pyridin-2-ylpyridine-2-carboxamide has a molecular weight of 283.33 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclobutyloxy-6-methyl-N-pyridin-2-ylpyridine-2-carboxamide is sourced from PubChem (CID 118612946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).