N-[6-[(5-methyl-1,2-oxazol-3-yl)amino]-3-pyridinyl]oxane-4-carboxamide

C15H18N4O3 — CID 113023357

IUPACN-[6-[(5-methyl-1,2-oxazol-3-yl)amino]-3-pyridinyl]oxane-4-carboxamide
SMILESCc1cc(Nc2ccc(NC(=O)C3CCOCC3)cn2)no1
InChIInChI=1S/C15H18N4O3/c1-10-8-14(19-22-10)18-13-3-2-12(9-16-13)17-15(20)11-4-6-21-7-5-11/h2-3,8-9,11H,4-7H2,1H3,(H,17,20)(H,16,18,19)
InChIKeyQJFPUQBSIMXAJR-UHFFFAOYSA-N
MW302.33 g/mol
LogP2.49
Rot. Bonds4

About N-[6-[(5-methyl-1,2-oxazol-3-yl)amino]-3-pyridinyl]oxane-4-carboxamide

N-[6-[(5-methyl-1,2-oxazol-3-yl)amino]-3-pyridinyl]oxane-4-carboxamide (PubChem CID 113023357) has the molecular formula C15H18N4O3 and a molecular weight of 302.33 g/mol. Its IUPAC name is N-[6-[(5-methyl-1,2-oxazol-3-yl)amino]-3-pyridinyl]oxane-4-carboxamide.

Molecular Properties

Compound NameN-[6-[(5-methyl-1,2-oxazol-3-yl)amino]-3-pyridinyl]oxane-4-carboxamide
PubChem CID113023357
Molecular FormulaC15H18N4O3
Molecular Weight302.33 g/mol
Exact Mass302.14
IUPAC NameN-[6-[(5-methyl-1,2-oxazol-3-yl)amino]-3-pyridinyl]oxane-4-carboxamide
SMILESCc1cc(Nc2ccc(NC(=O)C3CCOCC3)cn2)no1
InChIInChI=1S/C15H18N4O3/c1-10-8-14(19-22-10)18-13-3-2-12(9-16-13)17-15(20)11-4-6-21-7-5-11/h2-3,8-9,11H,4-7H2,1H3,(H,17,20)(H,16,18,19)
InChIKeyQJFPUQBSIMXAJR-UHFFFAOYSA-N
XLogP2.49
TPSA89.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-[(5-methyl-1,2-oxazol-3-yl)amino]phenyl]oxane-4-carboxamide
CID 112990399
N-[6-(2,6-dimethylanilino)-3-pyridinyl]oxane-4-carboxamide
CID 113017207
N-(5-methyl-1,2-oxazol-3-yl)oxane-4-carboxamide
CID 110690048
N-[6-(4-bromo-2-methylanilino)-3-pyridinyl]oxane-4-carboxamide
CID 113021511
N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]oxane-4-carboxamide
CID 113020060
N-[6-(3-chloro-4-fluoroanilino)-3-pyridinyl]oxane-4-carboxamide
CID 113019012
methyl 3-[[5-(oxane-4-carbonylamino)-2-pyridinyl]amino]benzoate
CID 113020710
(3R)-N-(5-methyl-1,2-oxazol-3-yl)oxolane-3-carboxamide
CID 27242204
N-[6-[3-(trifluoromethyl)anilino]-3-pyridinyl]oxane-4-carboxamide
CID 113020231
N-[5-(4-acetylanilino)-2-pyridinyl]oxane-4-carboxamide
CID 113035088
N-[6-(2-cyanoanilino)-3-pyridinyl]oxane-4-carboxamide
CID 113022700
N-[6-(2-methylanilino)-3-pyridinyl]cyclopropanecarboxamide
CID 113016079

Frequently Asked Questions

What is the IUPAC name of N-[6-[(5-methyl-1,2-oxazol-3-yl)amino]-3-pyridinyl]oxane-4-carboxamide?
The IUPAC name of N-[6-[(5-methyl-1,2-oxazol-3-yl)amino]-3-pyridinyl]oxane-4-carboxamide (CID 113023357) is N-[6-[(5-methyl-1,2-oxazol-3-yl)amino]-3-pyridinyl]oxane-4-carboxamide.
What is the SMILES notation for N-[6-[(5-methyl-1,2-oxazol-3-yl)amino]-3-pyridinyl]oxane-4-carboxamide?
The canonical SMILES for N-[6-[(5-methyl-1,2-oxazol-3-yl)amino]-3-pyridinyl]oxane-4-carboxamide is Cc1cc(Nc2ccc(NC(=O)C3CCOCC3)cn2)no1.
What is the InChIKey of N-[6-[(5-methyl-1,2-oxazol-3-yl)amino]-3-pyridinyl]oxane-4-carboxamide?
The InChIKey is QJFPUQBSIMXAJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O3/c1-10-8-14(19-22-10)18-13-3-2-12(9-16-13)17-15(20)11-4-6-21-7-5-11/h2-3,8-9,11H,4-7H2,1H3,(H,17,20)(H,16,18,19).
What are the key properties of N-[6-[(5-methyl-1,2-oxazol-3-yl)amino]-3-pyridinyl]oxane-4-carboxamide?
N-[6-[(5-methyl-1,2-oxazol-3-yl)amino]-3-pyridinyl]oxane-4-carboxamide has a molecular weight of 302.33 g/mol, XLogP of 2.49, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[(5-methyl-1,2-oxazol-3-yl)amino]-3-pyridinyl]oxane-4-carboxamide is sourced from PubChem (CID 113023357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).