[5-(1,3-diethylpyrazol-5-yl)-1,3-oxazol-2-yl]methanamine

C11H16N4O — CID 66119658

IUPAC[5-(1,3-diethylpyrazol-5-yl)-1,3-oxazol-2-yl]methanamine
SMILESCCc1cc(-c2cnc(CN)o2)n(CC)n1
InChIInChI=1S/C11H16N4O/c1-3-8-5-9(15(4-2)14-8)10-7-13-11(6-12)16-10/h5,7H,3-4,6,12H2,1-2H3
InChIKeyYOBUXKNZGUMZJJ-UHFFFAOYSA-N
MW220.28 g/mol
LogP1.58
Rot. Bonds4

About [5-(1,3-diethylpyrazol-5-yl)-1,3-oxazol-2-yl]methanamine

[5-(1,3-diethylpyrazol-5-yl)-1,3-oxazol-2-yl]methanamine (PubChem CID 66119658) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is [5-(1,3-diethylpyrazol-5-yl)-1,3-oxazol-2-yl]methanamine.

Molecular Properties

Compound Name[5-(1,3-diethylpyrazol-5-yl)-1,3-oxazol-2-yl]methanamine
PubChem CID66119658
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name[5-(1,3-diethylpyrazol-5-yl)-1,3-oxazol-2-yl]methanamine
SMILESCCc1cc(-c2cnc(CN)o2)n(CC)n1
InChIInChI=1S/C11H16N4O/c1-3-8-5-9(15(4-2)14-8)10-7-13-11(6-12)16-10/h5,7H,3-4,6,12H2,1-2H3
InChIKeyYOBUXKNZGUMZJJ-UHFFFAOYSA-N
XLogP1.58
TPSA69.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(Z)-1-(5-(Pyridazin-3-yl)oxazol-2-yl)octadec-9-en-1-one
CID 11338876
(Z)-1-(5-pyridazin-3-yl-1,3-oxazol-2-yl)nonadec-8-en-1-one
CID 44452858
1-methyl-3-(trifluoromethyl)-N-[(4S)-2-[2-(trifluoromethyl)-1,3-oxazol-5-yl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-yl]pyrazole-5-carboxamide
CID 177051076
3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-[(2-methylpyrazol-3-yl)methyl]propanamide
CID 37699590
N-[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]-1-methylpyrazol-4-amine
CID 99822895
5-(2-Ethyl-5-methylpyrazol-3-yl)-2-(oxan-4-yl)-1,3-oxazole
CID 136570458
N-[(2S)-1-amino-3-(3-fluorophenyl)propan-2-yl]-2-(2-methylpyrazol-3-yl)-1,3-oxazole-5-carboxamide
CID 44554991
1-[(2-Fluorophenyl)methyl]-5-(1,3-oxazol-2-yl)pyrazole-3-carboximidamide
CID 68642419
5-(1-Ethyl-4-fluoro-5-methylpyrazol-3-yl)-2-methyl-1,3-oxazole
CID 70851824
[5-(1-Ethyl-4-fluoro-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]methanamine
CID 71055534
5-(1-Ethyl-4-fluoro-5-methylpyrazol-3-yl)-1,3-oxazole
CID 89032535
5-(1-Ethyl-4-fluoro-3-methylpyrazol-5-yl)-1,3-oxazole
CID 89147279

Frequently Asked Questions

What is the IUPAC name of [5-(1,3-diethylpyrazol-5-yl)-1,3-oxazol-2-yl]methanamine?
The IUPAC name of [5-(1,3-diethylpyrazol-5-yl)-1,3-oxazol-2-yl]methanamine (CID 66119658) is [5-(1,3-diethylpyrazol-5-yl)-1,3-oxazol-2-yl]methanamine.
What is the SMILES notation for [5-(1,3-diethylpyrazol-5-yl)-1,3-oxazol-2-yl]methanamine?
The canonical SMILES for [5-(1,3-diethylpyrazol-5-yl)-1,3-oxazol-2-yl]methanamine is CCc1cc(-c2cnc(CN)o2)n(CC)n1.
What is the InChIKey of [5-(1,3-diethylpyrazol-5-yl)-1,3-oxazol-2-yl]methanamine?
The InChIKey is YOBUXKNZGUMZJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-3-8-5-9(15(4-2)14-8)10-7-13-11(6-12)16-10/h5,7H,3-4,6,12H2,1-2H3.
What are the key properties of [5-(1,3-diethylpyrazol-5-yl)-1,3-oxazol-2-yl]methanamine?
[5-(1,3-diethylpyrazol-5-yl)-1,3-oxazol-2-yl]methanamine has a molecular weight of 220.28 g/mol, XLogP of 1.58, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(1,3-diethylpyrazol-5-yl)-1,3-oxazol-2-yl]methanamine is sourced from PubChem (CID 66119658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).