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

C12H17N5O2 — CID 55033953

IUPAC4-amino-5-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-1H-pyrazole-3-carboxamide
SMILESCCc1[nH]nc(C(=O)N(C)Cc2cc(C)on2)c1N
InChIInChI=1S/C12H17N5O2/c1-4-9-10(13)11(15-14-9)12(18)17(3)6-8-5-7(2)19-16-8/h5H,4,6,13H2,1-3H3,(H,14,15)
InChIKeySTFAWKKHXYVNAP-UHFFFAOYSA-N
MW263.30 g/mol
LogP1.12
Rot. Bonds4

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

4-amino-5-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-1H-pyrazole-3-carboxamide (PubChem CID 55033953) has the molecular formula C12H17N5O2 and a molecular weight of 263.30 g/mol. Its IUPAC name is 4-amino-5-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-5-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-1H-pyrazole-3-carboxamide
PubChem CID55033953
Molecular FormulaC12H17N5O2
Molecular Weight263.30 g/mol
Exact Mass263.14
IUPAC Name4-amino-5-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-1H-pyrazole-3-carboxamide
SMILESCCc1[nH]nc(C(=O)N(C)Cc2cc(C)on2)c1N
InChIInChI=1S/C12H17N5O2/c1-4-9-10(13)11(15-14-9)12(18)17(3)6-8-5-7(2)19-16-8/h5H,4,6,13H2,1-3H3,(H,14,15)
InChIKeySTFAWKKHXYVNAP-UHFFFAOYSA-N
XLogP1.12
TPSA101.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-5-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-1H-pyrazole-3-carboxamide (CID 55033953) is 4-amino-5-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-5-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-5-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-1H-pyrazole-3-carboxamide is CCc1[nH]nc(C(=O)N(C)Cc2cc(C)on2)c1N.
What is the InChIKey of 4-amino-5-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-1H-pyrazole-3-carboxamide?
The InChIKey is STFAWKKHXYVNAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5O2/c1-4-9-10(13)11(15-14-9)12(18)17(3)6-8-5-7(2)19-16-8/h5H,4,6,13H2,1-3H3,(H,14,15).
What are the key properties of 4-amino-5-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-1H-pyrazole-3-carboxamide?
4-amino-5-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-1H-pyrazole-3-carboxamide has a molecular weight of 263.30 g/mol, XLogP of 1.12, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 55033953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).