3-phenyl-5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)-1,2-oxazole

C15H14N4O — CID 56704921

IUPAC3-phenyl-5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)-1,2-oxazole
SMILESc1ccc(-c2cc(C3NCCc4[nH]cnc43)on2)cc1
InChIInChI=1S/C15H14N4O/c1-2-4-10(5-3-1)12-8-13(20-19-12)15-14-11(6-7-16-15)17-9-18-14/h1-5,8-9,15-16H,6-7H2,(H,17,18)
InChIKeyUDCULIIAGNODNL-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.30
Rot. Bonds2

About 3-phenyl-5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)-1,2-oxazole

3-phenyl-5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)-1,2-oxazole (PubChem CID 56704921) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is 3-phenyl-5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)-1,2-oxazole.

Molecular Properties

Compound Name3-phenyl-5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)-1,2-oxazole
PubChem CID56704921
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC Name3-phenyl-5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)-1,2-oxazole
SMILESc1ccc(-c2cc(C3NCCc4[nH]cnc43)on2)cc1
InChIInChI=1S/C15H14N4O/c1-2-4-10(5-3-1)12-8-13(20-19-12)15-14-11(6-7-16-15)17-9-18-14/h1-5,8-9,15-16H,6-7H2,(H,17,18)
InChIKeyUDCULIIAGNODNL-UHFFFAOYSA-N
XLogP2.30
TPSA66.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-benzoylpiperazin-1-yl)-2-[4-(3-methylisoxazol-5-yl)-5H-pyrrolo[3,2-d]pyrimidin-7-yl]ethane-1,2-dione
CID 59729296
N1-[4-(3-phenylisoxazol-5-yl)pyrimidin-2-yl]acetamide
CID 2745719
N-isopropyl-2-(4-(3,5-dimethylisoxazol-4-yl)phenyl)imidazo[1,2-a]pyrazin-3-amine
CID 117834061
N-cyclohexyl-2-[4-(3,5-dimethyl-4-isoxazolyl)phenyl]-imidazo[1,2-a]pyridin-3-amine
CID 117834606
N-tert-butyl-2-(4-(3,5-dimethylisoxazol-4-yl)phenyl)imidazo[1,2-a]pyrimidin-3-amine
CID 117841270
5-methyl-N-[(2S)-4-[(2S)-2-methylpiperidin-1-yl]-1,4-dioxo-1-[[(1S)-1-(5-phenyl-1H-imidazol-2-yl)ethyl]amino]butan-2-yl]-1,2-oxazole-3-carboxamide
CID 138545265
N-cyclopentyl-4-(5-phenyl-1,2-oxazol-3-yl)-6-propan-2-ylpyrimidin-2-amine
CID 16682192
5-(Imidazol-1-ylmethyl)-3-phenyl-1,2-oxazole
CID 137655303
4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-N-[(3R)-pyrrolidin-3-yl]pyrimidin-2-amine
CID 145993761
4-(1H-Benzo[d]imidazol-6-yl)-3,5-dimethylisoxazole
CID 90667397
N-butyl-2-[4-(3,5-dimethyl-4-isoxazolyl)phenyl]-imidazo[1,2-a]pyrazin-3-amine
CID 117834640
N-tert-butyl-2-(5-(3,5-dimethylisoxazol-4-yl)pyridin-2-yl)imidazo[1,2-a]pyrazin-3-amine
CID 117841252

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)-1,2-oxazole?
The IUPAC name of 3-phenyl-5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)-1,2-oxazole (CID 56704921) is 3-phenyl-5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)-1,2-oxazole.
What is the SMILES notation for 3-phenyl-5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)-1,2-oxazole?
The canonical SMILES for 3-phenyl-5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)-1,2-oxazole is c1ccc(-c2cc(C3NCCc4[nH]cnc43)on2)cc1.
What is the InChIKey of 3-phenyl-5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)-1,2-oxazole?
The InChIKey is UDCULIIAGNODNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O/c1-2-4-10(5-3-1)12-8-13(20-19-12)15-14-11(6-7-16-15)17-9-18-14/h1-5,8-9,15-16H,6-7H2,(H,17,18).
What are the key properties of 3-phenyl-5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)-1,2-oxazole?
3-phenyl-5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)-1,2-oxazole has a molecular weight of 266.30 g/mol, XLogP of 2.30, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)-1,2-oxazole is sourced from PubChem (CID 56704921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).