N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)-2-pyridinyl]oxolane-3-carboxamide

C13H15N5O2 — CID 138989340

IUPACN-[4-(5-methyl-1H-1,2,4-triazol-3-yl)-2-pyridinyl]oxolane-3-carboxamide
SMILESCc1nc(-c2ccnc(NC(=O)C3CCOC3)c2)n[nH]1
InChIInChI=1S/C13H15N5O2/c1-8-15-12(18-17-8)9-2-4-14-11(6-9)16-13(19)10-3-5-20-7-10/h2,4,6,10H,3,5,7H2,1H3,(H,14,16,19)(H,15,17,18)
InChIKeyNWQIQGDPUZKDMF-UHFFFAOYSA-N
MW273.30 g/mol
LogP1.15
Rot. Bonds3

About N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)-2-pyridinyl]oxolane-3-carboxamide

N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)-2-pyridinyl]oxolane-3-carboxamide (PubChem CID 138989340) has the molecular formula C13H15N5O2 and a molecular weight of 273.30 g/mol. Its IUPAC name is N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)-2-pyridinyl]oxolane-3-carboxamide.

Molecular Properties

Compound NameN-[4-(5-methyl-1H-1,2,4-triazol-3-yl)-2-pyridinyl]oxolane-3-carboxamide
PubChem CID138989340
Molecular FormulaC13H15N5O2
Molecular Weight273.30 g/mol
Exact Mass273.12
IUPAC NameN-[4-(5-methyl-1H-1,2,4-triazol-3-yl)-2-pyridinyl]oxolane-3-carboxamide
SMILESCc1nc(-c2ccnc(NC(=O)C3CCOC3)c2)n[nH]1
InChIInChI=1S/C13H15N5O2/c1-8-15-12(18-17-8)9-2-4-14-11(6-9)16-13(19)10-3-5-20-7-10/h2,4,6,10H,3,5,7H2,1H3,(H,14,16,19)(H,15,17,18)
InChIKeyNWQIQGDPUZKDMF-UHFFFAOYSA-N
XLogP1.15
TPSA92.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.30
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)-2-pyridinyl]-2-(thietan-3-yl)acetamide
CID 138989339
1-(4-hydroxybutyl)-3-[4-(5-methyl-1H-1,2,4-triazol-3-yl)-2-pyridinyl]urea
CID 126831645
(3R)-N-(5-methyl-1,2-oxazol-3-yl)oxolane-3-carboxamide
CID 27242204
N-[4-(5-cyclopropyl-2-methyl-1H-imidazol-4-yl)-2-pyridinyl]cyclopropanecarboxamide
CID 155562118
N-[2-(2-methyl-4-pyridinyl)-1H-pyrrolo[3,2-c]pyridin-6-yl]oxane-3-carboxamide
CID 164564847
N-[4-[5-(aminomethyl)-1H-1,2,4-triazol-3-yl]phenyl]oxolane-3-carboxamide
CID 120566585
N-[3-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]-2,3,4,5-tetrahydro-1-benzoxepine-4-carboxamide
CID 131923841
3-anilino-5-[2-(oxane-4-carbonylamino)-4-pyridinyl]benzoic acid
CID 11281501
N-[4-(2-methyl-4-pyrimidin-5-yl-1H-imidazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide
CID 155525697
N-(2-bromo-4-pyridinyl)oxolane-3-carboxamide
CID 130752406
N-[3-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]-2-(oxan-3-yl)acetamide
CID 131932133
N-[3-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]cyclohex-3-ene-1-carboxamide
CID 131909357

Frequently Asked Questions

What is the IUPAC name of N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)-2-pyridinyl]oxolane-3-carboxamide?
The IUPAC name of N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)-2-pyridinyl]oxolane-3-carboxamide (CID 138989340) is N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)-2-pyridinyl]oxolane-3-carboxamide.
What is the SMILES notation for N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)-2-pyridinyl]oxolane-3-carboxamide?
The canonical SMILES for N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)-2-pyridinyl]oxolane-3-carboxamide is Cc1nc(-c2ccnc(NC(=O)C3CCOC3)c2)n[nH]1.
What is the InChIKey of N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)-2-pyridinyl]oxolane-3-carboxamide?
The InChIKey is NWQIQGDPUZKDMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5O2/c1-8-15-12(18-17-8)9-2-4-14-11(6-9)16-13(19)10-3-5-20-7-10/h2,4,6,10H,3,5,7H2,1H3,(H,14,16,19)(H,15,17,18).
What are the key properties of N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)-2-pyridinyl]oxolane-3-carboxamide?
N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)-2-pyridinyl]oxolane-3-carboxamide has a molecular weight of 273.30 g/mol, XLogP of 1.15, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)-2-pyridinyl]oxolane-3-carboxamide is sourced from PubChem (CID 138989340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).