(5-amino-1,3-dihydropyrazol-2-yl)-[5-(4-methoxyphenyl)-1,3-oxazol-4-yl]methanone

C14H14N4O3 — CID 146095430

IUPAC(5-amino-1,3-dihydropyrazol-2-yl)-[5-(4-methoxyphenyl)-1,3-oxazol-4-yl]methanone
SMILESCOc1ccc(-c2ocnc2C(=O)N2CC=C(N)N2)cc1
InChIInChI=1S/C14H14N4O3/c1-20-10-4-2-9(3-5-10)13-12(16-8-21-13)14(19)18-7-6-11(15)17-18/h2-6,8,17H,7,15H2,1H3
InChIKeyVKNXJEHTZICMOW-UHFFFAOYSA-N
MW286.29 g/mol
LogP1.11
Rot. Bonds3

About (5-amino-1,3-dihydropyrazol-2-yl)-[5-(4-methoxyphenyl)-1,3-oxazol-4-yl]methanone

(5-amino-1,3-dihydropyrazol-2-yl)-[5-(4-methoxyphenyl)-1,3-oxazol-4-yl]methanone (PubChem CID 146095430) has the molecular formula C14H14N4O3 and a molecular weight of 286.29 g/mol. Its IUPAC name is (5-amino-1,3-dihydropyrazol-2-yl)-[5-(4-methoxyphenyl)-1,3-oxazol-4-yl]methanone.

Molecular Properties

Compound Name(5-amino-1,3-dihydropyrazol-2-yl)-[5-(4-methoxyphenyl)-1,3-oxazol-4-yl]methanone
PubChem CID146095430
Molecular FormulaC14H14N4O3
Molecular Weight286.29 g/mol
Exact Mass286.11
IUPAC Name(5-amino-1,3-dihydropyrazol-2-yl)-[5-(4-methoxyphenyl)-1,3-oxazol-4-yl]methanone
SMILESCOc1ccc(-c2ocnc2C(=O)N2CC=C(N)N2)cc1
InChIInChI=1S/C14H14N4O3/c1-20-10-4-2-9(3-5-10)13-12(16-8-21-13)14(19)18-7-6-11(15)17-18/h2-6,8,17H,7,15H2,1H3
InChIKeyVKNXJEHTZICMOW-UHFFFAOYSA-N
XLogP1.11
TPSA93.62 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.29
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze (5-amino-1,3-dihydropyrazol-2-yl)-[5-(4-methoxyphenyl)-1,3-oxazol-4-yl]methanone with MolForge

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Related Compounds

(7-hydroxy-5-azaspiro[2.4]heptan-5-yl)-[5-(4-methoxyphenyl)-1,3-oxazol-4-yl]methanone
CID 139002955
(3-cyclopropyl-2-azaspiro[3.3]heptan-2-yl)-[5-(4-methoxyphenyl)-1,3-oxazol-4-yl]methanone
CID 139009878
[5-(4-methoxyphenyl)-1,3-oxazol-4-yl]-(1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-yl)methanone
CID 146088841
[5-(4-methoxyphenyl)-1,3-oxazol-4-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone
CID 2738705
5-(4-methylphenyl)-1,3-oxazole-4-carboxamide
CID 2739751
5-(4-methoxyphenyl)-N-(2-methylphenyl)-1,3-oxazole-4-carboxamide
CID 20963550
N-(2,4-dimethoxyphenyl)-5-(4-methoxyphenyl)-1,3-oxazole-4-carboxamide
CID 20963534
2-[5-(4-methoxyphenyl)-1,3-oxazole-4-carbonyl]-10-propan-2-yl-2,6,10-triazaspiro[4.6]undecan-7-one
CID 146066916
5-(4-methoxyphenyl)-N-(pyridin-2-ylmethyl)-1,3-oxazole-4-carboxamide
CID 57401810
5-(4-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-1,3-oxazole-4-carboxamide
CID 20963569
N-[2-(4-methoxyphenoxy)ethyl]-5-phenyl-1,3-oxazole-4-carboxamide
CID 110689255
[(2R,6S)-2,6-dimethylmorpholin-4-yl]-[5-(4-fluorophenyl)-1,3-oxazol-4-yl]methanone
CID 51494370

Frequently Asked Questions

What is the IUPAC name of (5-amino-1,3-dihydropyrazol-2-yl)-[5-(4-methoxyphenyl)-1,3-oxazol-4-yl]methanone?
The IUPAC name of (5-amino-1,3-dihydropyrazol-2-yl)-[5-(4-methoxyphenyl)-1,3-oxazol-4-yl]methanone (CID 146095430) is (5-amino-1,3-dihydropyrazol-2-yl)-[5-(4-methoxyphenyl)-1,3-oxazol-4-yl]methanone.
What is the SMILES notation for (5-amino-1,3-dihydropyrazol-2-yl)-[5-(4-methoxyphenyl)-1,3-oxazol-4-yl]methanone?
The canonical SMILES for (5-amino-1,3-dihydropyrazol-2-yl)-[5-(4-methoxyphenyl)-1,3-oxazol-4-yl]methanone is COc1ccc(-c2ocnc2C(=O)N2CC=C(N)N2)cc1.
What is the InChIKey of (5-amino-1,3-dihydropyrazol-2-yl)-[5-(4-methoxyphenyl)-1,3-oxazol-4-yl]methanone?
The InChIKey is VKNXJEHTZICMOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O3/c1-20-10-4-2-9(3-5-10)13-12(16-8-21-13)14(19)18-7-6-11(15)17-18/h2-6,8,17H,7,15H2,1H3.
What are the key properties of (5-amino-1,3-dihydropyrazol-2-yl)-[5-(4-methoxyphenyl)-1,3-oxazol-4-yl]methanone?
(5-amino-1,3-dihydropyrazol-2-yl)-[5-(4-methoxyphenyl)-1,3-oxazol-4-yl]methanone has a molecular weight of 286.29 g/mol, XLogP of 1.11, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (5-amino-1,3-dihydropyrazol-2-yl)-[5-(4-methoxyphenyl)-1,3-oxazol-4-yl]methanone is sourced from PubChem (CID 146095430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).