1-(3-methyl-1,2-oxazol-5-yl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-5-ylmethyl)urea

C13H17N5O2 — CID 154869245

IUPAC1-(3-methyl-1,2-oxazol-5-yl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-5-ylmethyl)urea
SMILESCc1cc(NC(=O)NCC2CCCc3nccn32)on1
InChIInChI=1S/C13H17N5O2/c1-9-7-12(20-17-9)16-13(19)15-8-10-3-2-4-11-14-5-6-18(10)11/h5-7,10H,2-4,8H2,1H3,(H2,15,16,19)
InChIKeyMEYZAHQLEOAZQR-UHFFFAOYSA-N
MW275.31 g/mol
LogP1.88
Rot. Bonds3

About 1-(3-methyl-1,2-oxazol-5-yl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-5-ylmethyl)urea

1-(3-methyl-1,2-oxazol-5-yl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-5-ylmethyl)urea (PubChem CID 154869245) has the molecular formula C13H17N5O2 and a molecular weight of 275.31 g/mol. Its IUPAC name is 1-(3-methyl-1,2-oxazol-5-yl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-5-ylmethyl)urea.

Molecular Properties

Compound Name1-(3-methyl-1,2-oxazol-5-yl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-5-ylmethyl)urea
PubChem CID154869245
Molecular FormulaC13H17N5O2
Molecular Weight275.31 g/mol
Exact Mass275.14
IUPAC Name1-(3-methyl-1,2-oxazol-5-yl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-5-ylmethyl)urea
SMILESCc1cc(NC(=O)NCC2CCCc3nccn32)on1
InChIInChI=1S/C13H17N5O2/c1-9-7-12(20-17-9)16-13(19)15-8-10-3-2-4-11-14-5-6-18(10)11/h5-7,10H,2-4,8H2,1H3,(H2,15,16,19)
InChIKeyMEYZAHQLEOAZQR-UHFFFAOYSA-N
XLogP1.88
TPSA84.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(3-cyclopropyl-1,2-oxazol-5-yl)methyl]-3-(3-methyl-1,2-oxazol-5-yl)urea
CID 167934119
1-(3-methyl-1,2-oxazol-5-yl)-3-[(1R,2S)-2-pyrazol-1-ylcyclopentyl]urea
CID 154845601
1-[[(2S)-1,4-dithian-2-yl]methyl]-3-(3-methyl-1,2-oxazol-5-yl)urea
CID 95975313
1-(imidazo[1,2-a]pyridin-7-ylmethyl)-3-(3-methyl-1,2-oxazol-5-yl)urea
CID 167772547
1-(3-methyl-1,2-oxazol-5-yl)-3-[(5-methylpyrazin-2-yl)methyl]urea
CID 167862543
1-(3-methyl-1,2-oxazol-5-yl)-3-(2-pyrimidin-2-ylethyl)urea
CID 166274717
1-(furan-3-ylmethyl)-3-(3-methyl-1,2-oxazol-5-yl)urea
CID 154857494
1-(3-methyl-1,2-oxazol-5-yl)-3-(pyridazin-3-ylmethyl)urea
CID 154863683
2-[cyclohexyl(methyl)amino]-N-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 18154358
2-[3-(methylamino)piperidin-1-yl]-N-(3-methyl-1,2-oxazol-5-yl)acetamide;hydrochloride
CID 119920207
1-(2-hydroxyethylamino)-3-(3-methyl-1,2-oxazol-5-yl)urea
CID 90203017
(2S)-N-(3-methyl-1,2-oxazol-5-yl)-2-[(2S)-2-(1,2,4-triazol-1-ylmethyl)pyrrolidin-1-yl]propanamide
CID 129461455

Frequently Asked Questions

What is the IUPAC name of 1-(3-methyl-1,2-oxazol-5-yl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-5-ylmethyl)urea?
The IUPAC name of 1-(3-methyl-1,2-oxazol-5-yl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-5-ylmethyl)urea (CID 154869245) is 1-(3-methyl-1,2-oxazol-5-yl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-5-ylmethyl)urea.
What is the SMILES notation for 1-(3-methyl-1,2-oxazol-5-yl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-5-ylmethyl)urea?
The canonical SMILES for 1-(3-methyl-1,2-oxazol-5-yl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-5-ylmethyl)urea is Cc1cc(NC(=O)NCC2CCCc3nccn32)on1.
What is the InChIKey of 1-(3-methyl-1,2-oxazol-5-yl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-5-ylmethyl)urea?
The InChIKey is MEYZAHQLEOAZQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O2/c1-9-7-12(20-17-9)16-13(19)15-8-10-3-2-4-11-14-5-6-18(10)11/h5-7,10H,2-4,8H2,1H3,(H2,15,16,19).
What are the key properties of 1-(3-methyl-1,2-oxazol-5-yl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-5-ylmethyl)urea?
1-(3-methyl-1,2-oxazol-5-yl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-5-ylmethyl)urea has a molecular weight of 275.31 g/mol, XLogP of 1.88, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methyl-1,2-oxazol-5-yl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-5-ylmethyl)urea is sourced from PubChem (CID 154869245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).