2-(cyclopropanecarbonylamino)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1,3-oxazole-4-carboxamide

C15H19N5O3 — CID 56765137

IUPAC2-(cyclopropanecarbonylamino)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1,3-oxazole-4-carboxamide
SMILESCc1cc(C)n(CCNC(=O)c2coc(NC(=O)C3CC3)n2)n1
InChIInChI=1S/C15H19N5O3/c1-9-7-10(2)20(19-9)6-5-16-14(22)12-8-23-15(17-12)18-13(21)11-3-4-11/h7-8,11H,3-6H2,1-2H3,(H,16,22)(H,17,18,21)
InChIKeyDCWDPOKMCOTTPN-UHFFFAOYSA-N
MW317.35 g/mol
LogP1.27
Rot. Bonds6

About 2-(cyclopropanecarbonylamino)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1,3-oxazole-4-carboxamide

2-(cyclopropanecarbonylamino)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1,3-oxazole-4-carboxamide (PubChem CID 56765137) has the molecular formula C15H19N5O3 and a molecular weight of 317.35 g/mol. Its IUPAC name is 2-(cyclopropanecarbonylamino)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name2-(cyclopropanecarbonylamino)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1,3-oxazole-4-carboxamide
PubChem CID56765137
Molecular FormulaC15H19N5O3
Molecular Weight317.35 g/mol
Exact Mass317.15
IUPAC Name2-(cyclopropanecarbonylamino)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1,3-oxazole-4-carboxamide
SMILESCc1cc(C)n(CCNC(=O)c2coc(NC(=O)C3CC3)n2)n1
InChIInChI=1S/C15H19N5O3/c1-9-7-10(2)20(19-9)6-5-16-14(22)12-8-23-15(17-12)18-13(21)11-3-4-11/h7-8,11H,3-6H2,1-2H3,(H,16,22)(H,17,18,21)
InChIKeyDCWDPOKMCOTTPN-UHFFFAOYSA-N
XLogP1.27
TPSA102.05 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.35
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropanecarbonylamino)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1,3-oxazole-4-carboxamide?
The IUPAC name of 2-(cyclopropanecarbonylamino)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1,3-oxazole-4-carboxamide (CID 56765137) is 2-(cyclopropanecarbonylamino)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 2-(cyclopropanecarbonylamino)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1,3-oxazole-4-carboxamide?
The canonical SMILES for 2-(cyclopropanecarbonylamino)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1,3-oxazole-4-carboxamide is Cc1cc(C)n(CCNC(=O)c2coc(NC(=O)C3CC3)n2)n1.
What is the InChIKey of 2-(cyclopropanecarbonylamino)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1,3-oxazole-4-carboxamide?
The InChIKey is DCWDPOKMCOTTPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O3/c1-9-7-10(2)20(19-9)6-5-16-14(22)12-8-23-15(17-12)18-13(21)11-3-4-11/h7-8,11H,3-6H2,1-2H3,(H,16,22)(H,17,18,21).
What are the key properties of 2-(cyclopropanecarbonylamino)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1,3-oxazole-4-carboxamide?
2-(cyclopropanecarbonylamino)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1,3-oxazole-4-carboxamide has a molecular weight of 317.35 g/mol, XLogP of 1.27, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropanecarbonylamino)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 56765137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).