N-(oxolan-2-ylmethyl)-6-pyridin-2-ylpyridine-3-carboxamide

C16H17N3O2 — CID 110681810

IUPACN-(oxolan-2-ylmethyl)-6-pyridin-2-ylpyridine-3-carboxamide
SMILESO=C(NCC1CCCO1)c1ccc(-c2ccccn2)nc1
InChIInChI=1S/C16H17N3O2/c20-16(19-11-13-4-3-9-21-13)12-6-7-15(18-10-12)14-5-1-2-8-17-14/h1-2,5-8,10,13H,3-4,9,11H2,(H,19,20)
InChIKeyOTBHPZPMRAIYOW-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.05
Rot. Bonds4

About N-(oxolan-2-ylmethyl)-6-pyridin-2-ylpyridine-3-carboxamide

N-(oxolan-2-ylmethyl)-6-pyridin-2-ylpyridine-3-carboxamide (PubChem CID 110681810) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is N-(oxolan-2-ylmethyl)-6-pyridin-2-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(oxolan-2-ylmethyl)-6-pyridin-2-ylpyridine-3-carboxamide
PubChem CID110681810
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC NameN-(oxolan-2-ylmethyl)-6-pyridin-2-ylpyridine-3-carboxamide
SMILESO=C(NCC1CCCO1)c1ccc(-c2ccccn2)nc1
InChIInChI=1S/C16H17N3O2/c20-16(19-11-13-4-3-9-21-13)12-6-7-15(18-10-12)14-5-1-2-8-17-14/h1-2,5-8,10,13H,3-4,9,11H2,(H,19,20)
InChIKeyOTBHPZPMRAIYOW-UHFFFAOYSA-N
XLogP2.05
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 ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(oxolan-2-ylmethyl)-6-pyridin-2-ylpyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(oxolan-2-ylmethyl)-6-thiophen-2-ylpyridine-3-carboxamide
CID 71830129
6-fluoro-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 63972348
N-(oxolan-2-ylmethyl)-6-thiophen-3-ylpyridine-3-carboxamide
CID 53149661
N-(oxolan-2-ylmethyl)-6-(oxolan-2-ylmethylamino)pyridine-3-carboxamide
CID 109153510
2-anilino-N-[[(2S)-oxolan-2-yl]methyl]pyrimidine-5-carboxamide
CID 97126626
N-(oxolan-2-ylmethyl)-2-(oxolan-2-ylmethylamino)pyrimidine-5-carboxamide
CID 109252326
6-morpholin-4-yl-N-[[(2S)-oxolan-2-yl]methyl]pyridine-3-carboxamide
CID 724881
N-(oxolan-2-ylmethyl)-4-(pyridin-2-ylmethylsulfamoyl)benzamide
CID 109059990
6-(dipropylamino)-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 109153658
N-(oxan-3-ylmethyl)-2-pyridin-2-ylpyrimidine-5-carboxamide
CID 119067967
6-[benzyl(ethyl)amino]-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 109153623
9,10-dioxo-N-[[(2S)-oxolan-2-yl]methyl]anthracene-2-carboxamide
CID 42559548

Frequently Asked Questions

What is the IUPAC name of N-(oxolan-2-ylmethyl)-6-pyridin-2-ylpyridine-3-carboxamide?
The IUPAC name of N-(oxolan-2-ylmethyl)-6-pyridin-2-ylpyridine-3-carboxamide (CID 110681810) is N-(oxolan-2-ylmethyl)-6-pyridin-2-ylpyridine-3-carboxamide.
What is the SMILES notation for N-(oxolan-2-ylmethyl)-6-pyridin-2-ylpyridine-3-carboxamide?
The canonical SMILES for N-(oxolan-2-ylmethyl)-6-pyridin-2-ylpyridine-3-carboxamide is O=C(NCC1CCCO1)c1ccc(-c2ccccn2)nc1.
What is the InChIKey of N-(oxolan-2-ylmethyl)-6-pyridin-2-ylpyridine-3-carboxamide?
The InChIKey is OTBHPZPMRAIYOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c20-16(19-11-13-4-3-9-21-13)12-6-7-15(18-10-12)14-5-1-2-8-17-14/h1-2,5-8,10,13H,3-4,9,11H2,(H,19,20).
What are the key properties of N-(oxolan-2-ylmethyl)-6-pyridin-2-ylpyridine-3-carboxamide?
N-(oxolan-2-ylmethyl)-6-pyridin-2-ylpyridine-3-carboxamide has a molecular weight of 283.33 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-2-ylmethyl)-6-pyridin-2-ylpyridine-3-carboxamide is sourced from PubChem (CID 110681810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).