4-amino-1-ethyl-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-5-carboxamide

C13H19N5O2 — CID 106387457

IUPAC4-amino-1-ethyl-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-5-carboxamide
SMILESCCn1nc(C)c(N)c1C(=O)NC(C)c1ncc(C)o1
InChIInChI=1S/C13H19N5O2/c1-5-18-11(10(14)8(3)17-18)12(19)16-9(4)13-15-6-7(2)20-13/h6,9H,5,14H2,1-4H3,(H,16,19)
InChIKeyFXYGCARGLDAQHP-UHFFFAOYSA-N
MW277.33 g/mol
LogP1.58
Rot. Bonds4

About 4-amino-1-ethyl-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-5-carboxamide

4-amino-1-ethyl-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-5-carboxamide (PubChem CID 106387457) has the molecular formula C13H19N5O2 and a molecular weight of 277.33 g/mol. Its IUPAC name is 4-amino-1-ethyl-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-1-ethyl-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-5-carboxamide
PubChem CID106387457
Molecular FormulaC13H19N5O2
Molecular Weight277.33 g/mol
Exact Mass277.15
IUPAC Name4-amino-1-ethyl-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-5-carboxamide
SMILESCCn1nc(C)c(N)c1C(=O)NC(C)c1ncc(C)o1
InChIInChI=1S/C13H19N5O2/c1-5-18-11(10(14)8(3)17-18)12(19)16-9(4)13-15-6-7(2)20-13/h6,9H,5,14H2,1-4H3,(H,16,19)
InChIKeyFXYGCARGLDAQHP-UHFFFAOYSA-N
XLogP1.58
TPSA98.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1-ethyl-3-methyl-5-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-4,5-diamine
CID 114182304
4-amino-1-ethyl-N-(3-ethylpentan-2-yl)-3-methylpyrazole-5-carboxamide
CID 66125647
4-amino-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-1-ethyl-3-methylpyrazole-5-carboxamide
CID 66124661
4-amino-N-[1-(dimethylamino)propan-2-yl]-1-ethyl-3-methylpyrazole-5-carboxamide
CID 82944743
4-amino-N-(1-cyclopropylpropan-2-yl)-1-ethyl-3-methylpyrazole-5-carboxamide
CID 66123131
4-amino-1-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-3-carboxamide
CID 114182277
4-amino-1-ethyl-3-methyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrazole-5-carboxamide
CID 66123889
1-ethyl-1-methyl-3-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]urea
CID 103952282
(2S,3S)-2-amino-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pentanamide
CID 103951387
N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-2-sulfanylacetamide
CID 106390070
1-(2-aminoethyl)-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]imidazole-4-carboxamide
CID 106388320
3-amino-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-3-sulfanylidenepropanamide
CID 106388530

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-ethyl-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-5-carboxamide?
The IUPAC name of 4-amino-1-ethyl-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-5-carboxamide (CID 106387457) is 4-amino-1-ethyl-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-5-carboxamide.
What is the SMILES notation for 4-amino-1-ethyl-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-5-carboxamide?
The canonical SMILES for 4-amino-1-ethyl-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-5-carboxamide is CCn1nc(C)c(N)c1C(=O)NC(C)c1ncc(C)o1.
What is the InChIKey of 4-amino-1-ethyl-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-5-carboxamide?
The InChIKey is FXYGCARGLDAQHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5O2/c1-5-18-11(10(14)8(3)17-18)12(19)16-9(4)13-15-6-7(2)20-13/h6,9H,5,14H2,1-4H3,(H,16,19).
What are the key properties of 4-amino-1-ethyl-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-5-carboxamide?
4-amino-1-ethyl-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-5-carboxamide has a molecular weight of 277.33 g/mol, XLogP of 1.58, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-ethyl-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-5-carboxamide is sourced from PubChem (CID 106387457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).