N-(2,5-difluorophenyl)-N-methyl-2-[(3S)-oxolan-3-yl]oxypyridine-4-carboxamide

C17H16F2N2O3 — CID 97353319

IUPACN-(2,5-difluorophenyl)-N-methyl-2-[(3S)-oxolan-3-yl]oxypyridine-4-carboxamide
SMILESCN(C(=O)c1ccnc(O[C@H]2CCOC2)c1)c1cc(F)ccc1F
InChIInChI=1S/C17H16F2N2O3/c1-21(15-9-12(18)2-3-14(15)19)17(22)11-4-6-20-16(8-11)24-13-5-7-23-10-13/h2-4,6,8-9,13H,5,7,10H2,1H3/t13-/m0/s1
InChIKeySEVKJFSBCTVWHN-ZDUSSCGKSA-N
MW334.32 g/mol
LogP2.80
Rot. Bonds4

About N-(2,5-difluorophenyl)-N-methyl-2-[(3S)-oxolan-3-yl]oxypyridine-4-carboxamide

N-(2,5-difluorophenyl)-N-methyl-2-[(3S)-oxolan-3-yl]oxypyridine-4-carboxamide (PubChem CID 97353319) has the molecular formula C17H16F2N2O3 and a molecular weight of 334.32 g/mol. Its IUPAC name is N-(2,5-difluorophenyl)-N-methyl-2-[(3S)-oxolan-3-yl]oxypyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2,5-difluorophenyl)-N-methyl-2-[(3S)-oxolan-3-yl]oxypyridine-4-carboxamide
PubChem CID97353319
Molecular FormulaC17H16F2N2O3
Molecular Weight334.32 g/mol
Exact Mass334.11
IUPAC NameN-(2,5-difluorophenyl)-N-methyl-2-[(3S)-oxolan-3-yl]oxypyridine-4-carboxamide
SMILESCN(C(=O)c1ccnc(O[C@H]2CCOC2)c1)c1cc(F)ccc1F
InChIInChI=1S/C17H16F2N2O3/c1-21(15-9-12(18)2-3-14(15)19)17(22)11-4-6-20-16(8-11)24-13-5-7-23-10-13/h2-4,6,8-9,13H,5,7,10H2,1H3/t13-/m0/s1
InChIKeySEVKJFSBCTVWHN-ZDUSSCGKSA-N
XLogP2.80
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.32
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(oxolan-3-yloxy)pyridine-4-carboxylic acid
CID 63559237
N-methyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide
CID 75504581
N-(2,6-difluorophenyl)-2-(oxolan-3-yloxy)pyridine-4-carboxamide
CID 91815300
N-[3-(dimethylamino)propyl]-2-[(3S)-oxolan-3-yl]oxypyridine-4-carboxamide
CID 124617634
N-[3-(dimethylamino)propyl]-2-(oxolan-3-yloxy)pyridine-4-carboxamide
CID 91815235
2-[4-[[methyl-[2-(oxolan-3-yloxy)pyridine-4-carbonyl]amino]methyl]phenoxy]acetic acid
CID 120538082
N-cyclododecyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide
CID 121160706
N-cyclohexyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide
CID 91815236
(2S)-2-[[2-(oxolan-3-yloxy)pyridine-4-carbonyl]amino]propanoic acid
CID 120525990
1-methyl-3-[2-(oxolan-3-yloxy)-4-pyridinyl]-1-phenylurea
CID 138004617
N-(5-chloro-2-methoxyphenyl)-2-[(3R)-oxolan-3-yl]oxypyridine-4-carboxamide
CID 124615990
(5-fluoro-2,3-dihydro-1,4-benzoxazin-4-yl)-[2-[(3S)-oxolan-3-yl]oxy-4-pyridinyl]methanone
CID 124617683

Frequently Asked Questions

What is the IUPAC name of N-(2,5-difluorophenyl)-N-methyl-2-[(3S)-oxolan-3-yl]oxypyridine-4-carboxamide?
The IUPAC name of N-(2,5-difluorophenyl)-N-methyl-2-[(3S)-oxolan-3-yl]oxypyridine-4-carboxamide (CID 97353319) is N-(2,5-difluorophenyl)-N-methyl-2-[(3S)-oxolan-3-yl]oxypyridine-4-carboxamide.
What is the SMILES notation for N-(2,5-difluorophenyl)-N-methyl-2-[(3S)-oxolan-3-yl]oxypyridine-4-carboxamide?
The canonical SMILES for N-(2,5-difluorophenyl)-N-methyl-2-[(3S)-oxolan-3-yl]oxypyridine-4-carboxamide is CN(C(=O)c1ccnc(O[C@H]2CCOC2)c1)c1cc(F)ccc1F.
What is the InChIKey of N-(2,5-difluorophenyl)-N-methyl-2-[(3S)-oxolan-3-yl]oxypyridine-4-carboxamide?
The InChIKey is SEVKJFSBCTVWHN-ZDUSSCGKSA-N. The full InChI is InChI=1S/C17H16F2N2O3/c1-21(15-9-12(18)2-3-14(15)19)17(22)11-4-6-20-16(8-11)24-13-5-7-23-10-13/h2-4,6,8-9,13H,5,7,10H2,1H3/t13-/m0/s1.
What are the key properties of N-(2,5-difluorophenyl)-N-methyl-2-[(3S)-oxolan-3-yl]oxypyridine-4-carboxamide?
N-(2,5-difluorophenyl)-N-methyl-2-[(3S)-oxolan-3-yl]oxypyridine-4-carboxamide has a molecular weight of 334.32 g/mol, XLogP of 2.80, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-difluorophenyl)-N-methyl-2-[(3S)-oxolan-3-yl]oxypyridine-4-carboxamide is sourced from PubChem (CID 97353319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).