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

C12H17N5O2 — CID 65357392

IUPAC4-amino-1-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyrazole-5-carboxamide
SMILESCCn1ncc(N)c1C(=O)N(C)Cc1cc(C)on1
InChIInChI=1S/C12H17N5O2/c1-4-17-11(10(13)6-14-17)12(18)16(3)7-9-5-8(2)19-15-9/h5-6H,4,7,13H2,1-3H3
InChIKeyRYARCGNPUATVMN-UHFFFAOYSA-N
MW263.30 g/mol
LogP1.05
Rot. Bonds4

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

4-amino-1-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyrazole-5-carboxamide (PubChem CID 65357392) has the molecular formula C12H17N5O2 and a molecular weight of 263.30 g/mol. Its IUPAC name is 4-amino-1-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyrazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-1-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyrazole-5-carboxamide
PubChem CID65357392
Molecular FormulaC12H17N5O2
Molecular Weight263.30 g/mol
Exact Mass263.14
IUPAC Name4-amino-1-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyrazole-5-carboxamide
SMILESCCn1ncc(N)c1C(=O)N(C)Cc1cc(C)on1
InChIInChI=1S/C12H17N5O2/c1-4-17-11(10(13)6-14-17)12(18)16(3)7-9-5-8(2)19-15-9/h5-6H,4,7,13H2,1-3H3
InChIKeyRYARCGNPUATVMN-UHFFFAOYSA-N
XLogP1.05
TPSA90.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-amino-1-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyrazole-5-carboxamide?
The IUPAC name of 4-amino-1-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyrazole-5-carboxamide (CID 65357392) is 4-amino-1-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyrazole-5-carboxamide.
What is the SMILES notation for 4-amino-1-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyrazole-5-carboxamide?
The canonical SMILES for 4-amino-1-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyrazole-5-carboxamide is CCn1ncc(N)c1C(=O)N(C)Cc1cc(C)on1.
What is the InChIKey of 4-amino-1-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyrazole-5-carboxamide?
The InChIKey is RYARCGNPUATVMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5O2/c1-4-17-11(10(13)6-14-17)12(18)16(3)7-9-5-8(2)19-15-9/h5-6H,4,7,13H2,1-3H3.
What are the key properties of 4-amino-1-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyrazole-5-carboxamide?
4-amino-1-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyrazole-5-carboxamide has a molecular weight of 263.30 g/mol, XLogP of 1.05, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-ethyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyrazole-5-carboxamide is sourced from PubChem (CID 65357392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).