N-ethyl-N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-2-propan-2-yl-1,3-oxazole-4-carboxamide

C16H24N4O2 — CID 53195258

IUPACN-ethyl-N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-2-propan-2-yl-1,3-oxazole-4-carboxamide
SMILESCCN(Cc1cnn(CC)c1)C(=O)c1nc(C(C)C)oc1C
InChIInChI=1S/C16H24N4O2/c1-6-19(9-13-8-17-20(7-2)10-13)16(21)14-12(5)22-15(18-14)11(3)4/h8,10-11H,6-7,9H2,1-5H3
InChIKeyQRNDCWJXJNWBHN-UHFFFAOYSA-N
MW304.39 g/mol
LogP2.99
Rot. Bonds6

About N-ethyl-N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-2-propan-2-yl-1,3-oxazole-4-carboxamide

N-ethyl-N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-2-propan-2-yl-1,3-oxazole-4-carboxamide (PubChem CID 53195258) has the molecular formula C16H24N4O2 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-ethyl-N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-2-propan-2-yl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-2-propan-2-yl-1,3-oxazole-4-carboxamide
PubChem CID53195258
Molecular FormulaC16H24N4O2
Molecular Weight304.39 g/mol
Exact Mass304.19
IUPAC NameN-ethyl-N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-2-propan-2-yl-1,3-oxazole-4-carboxamide
SMILESCCN(Cc1cnn(CC)c1)C(=O)c1nc(C(C)C)oc1C
InChIInChI=1S/C16H24N4O2/c1-6-19(9-13-8-17-20(7-2)10-13)16(21)14-12(5)22-15(18-14)11(3)4/h8,10-11H,6-7,9H2,1-5H3
InChIKeyQRNDCWJXJNWBHN-UHFFFAOYSA-N
XLogP2.99
TPSA64.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-ethyl-N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-2-propan-2-yl-1,3-oxazole-4-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 N-ethyl-N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-2-propan-2-yl-1,3-oxazole-4-carboxamide?
The IUPAC name of N-ethyl-N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-2-propan-2-yl-1,3-oxazole-4-carboxamide (CID 53195258) is N-ethyl-N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-2-propan-2-yl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-ethyl-N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-2-propan-2-yl-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-ethyl-N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-2-propan-2-yl-1,3-oxazole-4-carboxamide is CCN(Cc1cnn(CC)c1)C(=O)c1nc(C(C)C)oc1C.
What is the InChIKey of N-ethyl-N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-2-propan-2-yl-1,3-oxazole-4-carboxamide?
The InChIKey is QRNDCWJXJNWBHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O2/c1-6-19(9-13-8-17-20(7-2)10-13)16(21)14-12(5)22-15(18-14)11(3)4/h8,10-11H,6-7,9H2,1-5H3.
What are the key properties of N-ethyl-N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-2-propan-2-yl-1,3-oxazole-4-carboxamide?
N-ethyl-N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-2-propan-2-yl-1,3-oxazole-4-carboxamide has a molecular weight of 304.39 g/mol, XLogP of 2.99, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-2-propan-2-yl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 53195258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).