N-[[(2S)-oxolan-2-yl]methyl]-N-pyridin-4-ylquinoxaline-2-carboxamide

C19H18N4O2 — CID 129370507

IUPACN-[[(2S)-oxolan-2-yl]methyl]-N-pyridin-4-ylquinoxaline-2-carboxamide
SMILESO=C(c1cnc2ccccc2n1)N(C[C@@H]1CCCO1)c1ccncc1
InChIInChI=1S/C19H18N4O2/c24-19(18-12-21-16-5-1-2-6-17(16)22-18)23(13-15-4-3-11-25-15)14-7-9-20-10-8-14/h1-2,5-10,12,15H,3-4,11,13H2/t15-/m0/s1
InChIKeyRYQHWAGIRTVNOU-HNNXBMFYSA-N
MW334.38 g/mol
LogP2.85
Rot. Bonds4

About N-[[(2S)-oxolan-2-yl]methyl]-N-pyridin-4-ylquinoxaline-2-carboxamide

N-[[(2S)-oxolan-2-yl]methyl]-N-pyridin-4-ylquinoxaline-2-carboxamide (PubChem CID 129370507) has the molecular formula C19H18N4O2 and a molecular weight of 334.38 g/mol. Its IUPAC name is N-[[(2S)-oxolan-2-yl]methyl]-N-pyridin-4-ylquinoxaline-2-carboxamide.

Molecular Properties

Compound NameN-[[(2S)-oxolan-2-yl]methyl]-N-pyridin-4-ylquinoxaline-2-carboxamide
PubChem CID129370507
Molecular FormulaC19H18N4O2
Molecular Weight334.38 g/mol
Exact Mass334.14
IUPAC NameN-[[(2S)-oxolan-2-yl]methyl]-N-pyridin-4-ylquinoxaline-2-carboxamide
SMILESO=C(c1cnc2ccccc2n1)N(C[C@@H]1CCCO1)c1ccncc1
InChIInChI=1S/C19H18N4O2/c24-19(18-12-21-16-5-1-2-6-17(16)22-18)23(13-15-4-3-11-25-15)14-7-9-20-10-8-14/h1-2,5-10,12,15H,3-4,11,13H2/t15-/m0/s1
InChIKeyRYQHWAGIRTVNOU-HNNXBMFYSA-N
XLogP2.85
TPSA68.21 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[(2R)-oxolan-2-yl]methyl]-N-pyridin-4-ylindolizine-2-carboxamide
CID 95777230
3-methyl-N-(oxolan-2-ylmethyl)-N-pyridin-4-yl-1,2-oxazole-5-carboxamide
CID 136525666
5-chloro-N-[[(2R)-oxolan-2-yl]methyl]-N-pyridin-4-ylthiophene-2-carboxamide
CID 96547612
5-fluoro-2-methyl-N-[[(2R)-oxolan-2-yl]methyl]-N-pyridin-4-ylbenzamide
CID 96547592
N-(oxolan-2-ylmethyl)-N-pyridin-4-yl-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide
CID 146105531
2-methyl-5-nitro-N-[[(2R)-oxolan-2-yl]methyl]-N-pyridin-4-ylbenzamide
CID 96547608
N-(oxolan-2-ylmethyl)-5-propan-2-yl-N-pyridazin-4-ylpyridine-2-carboxamide
CID 167761276
N-methyl-N-(oxolan-2-ylmethyl)pyridine-4-carboxamide
CID 110733149
N-[5-chloro-2-[[(2S)-oxolan-2-yl]methoxy]phenyl]quinoxaline-2-carboxamide
CID 94645848
5-methyl-N-(oxolan-2-ylmethyl)-1-phenyl-N-pyridazin-4-yl-1,2,4-triazole-3-carboxamide
CID 166252472
N-methyl-N-[[(2R)-oxolan-2-yl]methyl]pyrimidine-4-carboxamide
CID 127943943
5-chloro-N-(oxolan-2-ylmethyl)-N-pyridazin-4-ylfuran-2-carboxamide
CID 126829951

Frequently Asked Questions

What is the IUPAC name of N-[[(2S)-oxolan-2-yl]methyl]-N-pyridin-4-ylquinoxaline-2-carboxamide?
The IUPAC name of N-[[(2S)-oxolan-2-yl]methyl]-N-pyridin-4-ylquinoxaline-2-carboxamide (CID 129370507) is N-[[(2S)-oxolan-2-yl]methyl]-N-pyridin-4-ylquinoxaline-2-carboxamide.
What is the SMILES notation for N-[[(2S)-oxolan-2-yl]methyl]-N-pyridin-4-ylquinoxaline-2-carboxamide?
The canonical SMILES for N-[[(2S)-oxolan-2-yl]methyl]-N-pyridin-4-ylquinoxaline-2-carboxamide is O=C(c1cnc2ccccc2n1)N(C[C@@H]1CCCO1)c1ccncc1.
What is the InChIKey of N-[[(2S)-oxolan-2-yl]methyl]-N-pyridin-4-ylquinoxaline-2-carboxamide?
The InChIKey is RYQHWAGIRTVNOU-HNNXBMFYSA-N. The full InChI is InChI=1S/C19H18N4O2/c24-19(18-12-21-16-5-1-2-6-17(16)22-18)23(13-15-4-3-11-25-15)14-7-9-20-10-8-14/h1-2,5-10,12,15H,3-4,11,13H2/t15-/m0/s1.
What are the key properties of N-[[(2S)-oxolan-2-yl]methyl]-N-pyridin-4-ylquinoxaline-2-carboxamide?
N-[[(2S)-oxolan-2-yl]methyl]-N-pyridin-4-ylquinoxaline-2-carboxamide has a molecular weight of 334.38 g/mol, XLogP of 2.85, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2S)-oxolan-2-yl]methyl]-N-pyridin-4-ylquinoxaline-2-carboxamide is sourced from PubChem (CID 129370507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).