(2S)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)oxolane-2-carboxamide

C13H19N3O2 — CID 128972669

IUPAC(2S)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)oxolane-2-carboxamide
SMILESO=C(NCC1CCc2nccn2C1)[C@@H]1CCCO1
InChIInChI=1S/C13H19N3O2/c17-13(11-2-1-7-18-11)15-8-10-3-4-12-14-5-6-16(12)9-10/h5-6,10-11H,1-4,7-9H2,(H,15,17)/t10?,11-/m0/s1
InChIKeyOPZNKJQZCPLXLT-DTIOYNMSSA-N
MW249.31 g/mol
LogP0.74
Rot. Bonds3

About (2S)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)oxolane-2-carboxamide

(2S)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)oxolane-2-carboxamide (PubChem CID 128972669) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is (2S)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)oxolane-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)oxolane-2-carboxamide
PubChem CID128972669
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name(2S)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)oxolane-2-carboxamide
SMILESO=C(NCC1CCc2nccn2C1)[C@@H]1CCCO1
InChIInChI=1S/C13H19N3O2/c17-13(11-2-1-7-18-11)15-8-10-3-4-12-14-5-6-16(12)9-10/h5-6,10-11H,1-4,7-9H2,(H,15,17)/t10?,11-/m0/s1
InChIKeyOPZNKJQZCPLXLT-DTIOYNMSSA-N
XLogP0.74
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2S)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)oxolane-2-carboxamide with MolForge

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Related Compounds

(3R)-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]oxane-3-carboxamide
CID 129478050
1-(6-methyl-3-pyridinyl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)urea
CID 128995677
1-pyridin-4-yl-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)urea
CID 128995675
4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethylcarbamoylamino)methyl]benzoic acid
CID 122020581
N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyrazole-5-carboxamide
CID 129472235
1-methyl-3-[1-(oxolan-2-yl)ethyl]-1-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)urea
CID 129006310
N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)propan-2-amine
CID 131134209
1-[(1-methoxycyclobutyl)methyl]-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)urea
CID 128995732
1-[(1-methoxycyclobutyl)methyl]-3-[[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]urea
CID 129474764
5-ethyl-3-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]furan-2-carboxamide
CID 129328694
1-(4-methyl-1,2-oxazol-3-yl)-3-[[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]urea
CID 129333685
N-[[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazo[1,2-a]pyridine-5-carboxamide
CID 129329951

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)oxolane-2-carboxamide?
The IUPAC name of (2S)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)oxolane-2-carboxamide (CID 128972669) is (2S)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)oxolane-2-carboxamide.
What is the SMILES notation for (2S)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)oxolane-2-carboxamide?
The canonical SMILES for (2S)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)oxolane-2-carboxamide is O=C(NCC1CCc2nccn2C1)[C@@H]1CCCO1.
What is the InChIKey of (2S)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)oxolane-2-carboxamide?
The InChIKey is OPZNKJQZCPLXLT-DTIOYNMSSA-N. The full InChI is InChI=1S/C13H19N3O2/c17-13(11-2-1-7-18-11)15-8-10-3-4-12-14-5-6-16(12)9-10/h5-6,10-11H,1-4,7-9H2,(H,15,17)/t10?,11-/m0/s1.
What are the key properties of (2S)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)oxolane-2-carboxamide?
(2S)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)oxolane-2-carboxamide has a molecular weight of 249.31 g/mol, XLogP of 0.74, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)oxolane-2-carboxamide is sourced from PubChem (CID 128972669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).