5-cyclopropyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-1,2-oxazole-3-carboxamide

C17H17N5O2 — CID 71797530

IUPAC5-cyclopropyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-1,2-oxazole-3-carboxamide
SMILESCn1nc(CNC(=O)c2cc(C3CC3)on2)cc1-c1ccncc1
InChIInChI=1S/C17H17N5O2/c1-22-15(11-4-6-18-7-5-11)8-13(20-22)10-19-17(23)14-9-16(24-21-14)12-2-3-12/h4-9,12H,2-3,10H2,1H3,(H,19,23)
InChIKeyVJTNDLRVIVVQIJ-UHFFFAOYSA-N
MW323.36 g/mol
LogP2.28
Rot. Bonds5

About 5-cyclopropyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-1,2-oxazole-3-carboxamide

5-cyclopropyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-1,2-oxazole-3-carboxamide (PubChem CID 71797530) has the molecular formula C17H17N5O2 and a molecular weight of 323.36 g/mol. Its IUPAC name is 5-cyclopropyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-1,2-oxazole-3-carboxamide
PubChem CID71797530
Molecular FormulaC17H17N5O2
Molecular Weight323.36 g/mol
Exact Mass323.14
IUPAC Name5-cyclopropyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-1,2-oxazole-3-carboxamide
SMILESCn1nc(CNC(=O)c2cc(C3CC3)on2)cc1-c1ccncc1
InChIInChI=1S/C17H17N5O2/c1-22-15(11-4-6-18-7-5-11)8-13(20-22)10-19-17(23)14-9-16(24-21-14)12-2-3-12/h4-9,12H,2-3,10H2,1H3,(H,19,23)
InChIKeyVJTNDLRVIVVQIJ-UHFFFAOYSA-N
XLogP2.28
TPSA85.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.36
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-cyclopropyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-1,2-oxazole-3-carboxamide with MolForge

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Related Compounds

5-cyclopropyl-N-[(3-methyl-4-oxophthalazin-1-yl)methyl]-1,2-oxazole-3-carboxamide
CID 71779472
N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]pyridine-3-carboxamide
CID 90554952
N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]butanamide
CID 90554937
1-methyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-2-oxopyridine-3-carboxamide
CID 71797491
N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]naphthalene-1-carboxamide
CID 90555005
3-methyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]butanamide
CID 90554943
2-methoxy-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]acetamide
CID 90554940
N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-2-(4-phenylphenyl)acetamide
CID 90555066
2-ethoxy-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]acetamide
CID 90554945
N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-3-(trifluoromethyl)benzamide
CID 90555037
5-cyclopropyl-N-[(1-pyridin-3-yltriazol-4-yl)methyl]-1,2-oxazole-3-carboxamide
CID 121197885
1-[(4-chlorophenyl)methyl]-3-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]urea
CID 90555219

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-cyclopropyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-1,2-oxazole-3-carboxamide (CID 71797530) is 5-cyclopropyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-cyclopropyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-1,2-oxazole-3-carboxamide is Cn1nc(CNC(=O)c2cc(C3CC3)on2)cc1-c1ccncc1.
What is the InChIKey of 5-cyclopropyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-1,2-oxazole-3-carboxamide?
The InChIKey is VJTNDLRVIVVQIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N5O2/c1-22-15(11-4-6-18-7-5-11)8-13(20-22)10-19-17(23)14-9-16(24-21-14)12-2-3-12/h4-9,12H,2-3,10H2,1H3,(H,19,23).
What are the key properties of 5-cyclopropyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-1,2-oxazole-3-carboxamide?
5-cyclopropyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-1,2-oxazole-3-carboxamide has a molecular weight of 323.36 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 71797530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).