(2S)-N-(3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)oxolane-2-carboxamide

C15H18N4O2 — CID 95101199

IUPAC(2S)-N-(3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)oxolane-2-carboxamide
SMILESO=C(Nc1cccn2c(C3CCC3)nnc12)[C@@H]1CCCO1
InChIInChI=1S/C15H18N4O2/c20-15(12-7-3-9-21-12)16-11-6-2-8-19-13(10-4-1-5-10)17-18-14(11)19/h2,6,8,10,12H,1,3-5,7,9H2,(H,16,20)/t12-/m0/s1
InChIKeyHGCJOLYNHBUKLL-LBPRGKRZSA-N
MW286.33 g/mol
LogP2.11
Rot. Bonds3

About (2S)-N-(3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)oxolane-2-carboxamide

(2S)-N-(3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)oxolane-2-carboxamide (PubChem CID 95101199) has the molecular formula C15H18N4O2 and a molecular weight of 286.33 g/mol. Its IUPAC name is (2S)-N-(3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)oxolane-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-(3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)oxolane-2-carboxamide
PubChem CID95101199
Molecular FormulaC15H18N4O2
Molecular Weight286.33 g/mol
Exact Mass286.14
IUPAC Name(2S)-N-(3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)oxolane-2-carboxamide
SMILESO=C(Nc1cccn2c(C3CCC3)nnc12)[C@@H]1CCCO1
InChIInChI=1S/C15H18N4O2/c20-15(12-7-3-9-21-12)16-11-6-2-8-19-13(10-4-1-5-10)17-18-14(11)19/h2,6,8,10,12H,1,3-5,7,9H2,(H,16,20)/t12-/m0/s1
InChIKeyHGCJOLYNHBUKLL-LBPRGKRZSA-N
XLogP2.11
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methylimidazo[1,2-a]pyridin-8-yl)oxolane-2-carboxamide
CID 110735212
N-(2-chloro-3-pyridinyl)oxolane-2-carboxamide
CID 4166852
N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)oxolane-2-carboxamide
CID 53204396
(2S)-N-[2-tert-butyl-3-[[(2S)-oxolane-2-carbonyl]amino]phenyl]oxolane-2-carboxamide
CID 58409794
N-(2-phenylphenyl)oxolane-2-carboxamide
CID 2995133
N-(2-carbamothioylphenyl)oxolane-2-carboxamide
CID 24701220
[(2R)-oxolan-2-yl]-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]methanone
CID 35896294
N-(3-hydroxy-2-methylphenyl)oxolane-2-carboxamide
CID 64793799
N-(2-cyanophenyl)oxolane-2-carboxamide
CID 2948515
N-(2,3-dichlorophenyl)oxolane-2-carboxamide
CID 3155144
2-[2-[[(2S)-oxolane-2-carbonyl]amino]phenyl]acetic acid
CID 104855642
(2R)-N-(2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)oxolane-2-carboxamide
CID 95110051

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)oxolane-2-carboxamide?
The IUPAC name of (2S)-N-(3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)oxolane-2-carboxamide (CID 95101199) is (2S)-N-(3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)oxolane-2-carboxamide.
What is the SMILES notation for (2S)-N-(3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)oxolane-2-carboxamide?
The canonical SMILES for (2S)-N-(3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)oxolane-2-carboxamide is O=C(Nc1cccn2c(C3CCC3)nnc12)[C@@H]1CCCO1.
What is the InChIKey of (2S)-N-(3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)oxolane-2-carboxamide?
The InChIKey is HGCJOLYNHBUKLL-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H18N4O2/c20-15(12-7-3-9-21-12)16-11-6-2-8-19-13(10-4-1-5-10)17-18-14(11)19/h2,6,8,10,12H,1,3-5,7,9H2,(H,16,20)/t12-/m0/s1.
What are the key properties of (2S)-N-(3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)oxolane-2-carboxamide?
(2S)-N-(3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)oxolane-2-carboxamide has a molecular weight of 286.33 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)oxolane-2-carboxamide is sourced from PubChem (CID 95101199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).