N-methyl-4-[4-[5-(2-methylpropyl)-1,2,4-oxadiazol-3-yl]phenoxy]pyridine-2-carboxamide

C19H20N4O3 — CID 142752190

IUPACN-methyl-4-[4-[5-(2-methylpropyl)-1,2,4-oxadiazol-3-yl]phenoxy]pyridine-2-carboxamide
SMILESCNC(=O)c1cc(Oc2ccc(-c3noc(CC(C)C)n3)cc2)ccn1
InChIInChI=1S/C19H20N4O3/c1-12(2)10-17-22-18(23-26-17)13-4-6-14(7-5-13)25-15-8-9-21-16(11-15)19(24)20-3/h4-9,11-12H,10H2,1-3H3,(H,20,24)
InChIKeyWUAVWQUJNUMXLQ-UHFFFAOYSA-N
MW352.39 g/mol
LogP3.48
Rot. Bonds6

About N-methyl-4-[4-[5-(2-methylpropyl)-1,2,4-oxadiazol-3-yl]phenoxy]pyridine-2-carboxamide

N-methyl-4-[4-[5-(2-methylpropyl)-1,2,4-oxadiazol-3-yl]phenoxy]pyridine-2-carboxamide (PubChem CID 142752190) has the molecular formula C19H20N4O3 and a molecular weight of 352.39 g/mol. Its IUPAC name is N-methyl-4-[4-[5-(2-methylpropyl)-1,2,4-oxadiazol-3-yl]phenoxy]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-4-[4-[5-(2-methylpropyl)-1,2,4-oxadiazol-3-yl]phenoxy]pyridine-2-carboxamide
PubChem CID142752190
Molecular FormulaC19H20N4O3
Molecular Weight352.39 g/mol
Exact Mass352.15
IUPAC NameN-methyl-4-[4-[5-(2-methylpropyl)-1,2,4-oxadiazol-3-yl]phenoxy]pyridine-2-carboxamide
SMILESCNC(=O)c1cc(Oc2ccc(-c3noc(CC(C)C)n3)cc2)ccn1
InChIInChI=1S/C19H20N4O3/c1-12(2)10-17-22-18(23-26-17)13-4-6-14(7-5-13)25-15-8-9-21-16(11-15)19(24)20-3/h4-9,11-12H,10H2,1-3H3,(H,20,24)
InChIKeyWUAVWQUJNUMXLQ-UHFFFAOYSA-N
XLogP3.48
TPSA90.14 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-[3-[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]phenoxy]-N-methylpyridine-2-carboxamide
CID 138549857
N-methyl-4-[[3-methyl-2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)-1-benzothiophen-6-yl]oxy]pyridine-2-carboxamide
CID 138549841
4-[4-[(4-hydroxyphenyl)diazenyl]phenoxy]-N-methylpyridine-2-carboxamide
CID 165438064
N-[4-[[2-(methylcarbamoyl)-4-pyridinyl]oxy]phenyl]carbamate
CID 86648443
4-[(6-amino-5-ethyl-3-pyridinyl)oxy]-N-methylpyridine-2-carboxamide
CID 169032834
4-(4-chlorophenyl)-N-[4-[[2-(methylcarbamoyl)-4-pyridinyl]oxy]phenyl]pyridine-2-carboxamide
CID 141417735
4-[4-[N-carbamoyl-4-[[2-(methylcarbamoyl)-4-pyridinyl]oxy]anilino]phenoxy]-N-methylpyridine-2-carboxamide
CID 23614583
N-methyl-4-[4-[(4-methylphenyl)carbamothioylamino]phenoxy]pyridine-2-carboxamide
CID 141473965
4-[4-[[(3,4-dimethylbenzoyl)amino]carbamoyl]phenoxy]-N-methylpyridine-2-carboxamide
CID 11212255
ethyl N-[4-[[2-(methylcarbamoyl)-4-pyridinyl]oxy]phenyl]carbamate
CID 138110037
2-[[3-[4-[[6-(methylcarbamoyl)-2-pyridinyl]oxy]phenyl]-1,2,4-oxadiazol-5-yl]methyl]prop-2-enoic acid
CID 170637181
tert-butyl 2-diethoxyphosphoryl-3-[3-[4-[[2-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]-1,2,4-oxadiazol-5-yl]propanoate
CID 170637036

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[4-[5-(2-methylpropyl)-1,2,4-oxadiazol-3-yl]phenoxy]pyridine-2-carboxamide?
The IUPAC name of N-methyl-4-[4-[5-(2-methylpropyl)-1,2,4-oxadiazol-3-yl]phenoxy]pyridine-2-carboxamide (CID 142752190) is N-methyl-4-[4-[5-(2-methylpropyl)-1,2,4-oxadiazol-3-yl]phenoxy]pyridine-2-carboxamide.
What is the SMILES notation for N-methyl-4-[4-[5-(2-methylpropyl)-1,2,4-oxadiazol-3-yl]phenoxy]pyridine-2-carboxamide?
The canonical SMILES for N-methyl-4-[4-[5-(2-methylpropyl)-1,2,4-oxadiazol-3-yl]phenoxy]pyridine-2-carboxamide is CNC(=O)c1cc(Oc2ccc(-c3noc(CC(C)C)n3)cc2)ccn1.
What is the InChIKey of N-methyl-4-[4-[5-(2-methylpropyl)-1,2,4-oxadiazol-3-yl]phenoxy]pyridine-2-carboxamide?
The InChIKey is WUAVWQUJNUMXLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O3/c1-12(2)10-17-22-18(23-26-17)13-4-6-14(7-5-13)25-15-8-9-21-16(11-15)19(24)20-3/h4-9,11-12H,10H2,1-3H3,(H,20,24).
What are the key properties of N-methyl-4-[4-[5-(2-methylpropyl)-1,2,4-oxadiazol-3-yl]phenoxy]pyridine-2-carboxamide?
N-methyl-4-[4-[5-(2-methylpropyl)-1,2,4-oxadiazol-3-yl]phenoxy]pyridine-2-carboxamide has a molecular weight of 352.39 g/mol, XLogP of 3.48, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[4-[5-(2-methylpropyl)-1,2,4-oxadiazol-3-yl]phenoxy]pyridine-2-carboxamide is sourced from PubChem (CID 142752190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).