N-propyl-2,5-dihydro-1,2-oxazole-5-carboxamide

C7H12N2O2 — CID 143180198

IUPACN-propyl-2,5-dihydro-1,2-oxazole-5-carboxamide
SMILESCCCNC(=O)C1C=CNO1
InChIInChI=1S/C7H12N2O2/c1-2-4-8-7(10)6-3-5-9-11-6/h3,5-6,9H,2,4H2,1H3,(H,8,10)
InChIKeyWPOAACQRXNXSQD-UHFFFAOYSA-N
MW156.19 g/mol
LogP-0.07
Rot. Bonds3

About N-propyl-2,5-dihydro-1,2-oxazole-5-carboxamide

N-propyl-2,5-dihydro-1,2-oxazole-5-carboxamide (PubChem CID 143180198) has the molecular formula C7H12N2O2 and a molecular weight of 156.19 g/mol. Its IUPAC name is N-propyl-2,5-dihydro-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-propyl-2,5-dihydro-1,2-oxazole-5-carboxamide
PubChem CID143180198
Molecular FormulaC7H12N2O2
Molecular Weight156.19 g/mol
Exact Mass156.09
IUPAC NameN-propyl-2,5-dihydro-1,2-oxazole-5-carboxamide
SMILESCCCNC(=O)C1C=CNO1
InChIInChI=1S/C7H12N2O2/c1-2-4-8-7(10)6-3-5-9-11-6/h3,5-6,9H,2,4H2,1H3,(H,8,10)
InChIKeyWPOAACQRXNXSQD-UHFFFAOYSA-N
XLogP-0.07
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.19
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-propyl-2,5-dihydro-1,2-oxazole-5-carboxamide?
The IUPAC name of N-propyl-2,5-dihydro-1,2-oxazole-5-carboxamide (CID 143180198) is N-propyl-2,5-dihydro-1,2-oxazole-5-carboxamide.
What is the SMILES notation for N-propyl-2,5-dihydro-1,2-oxazole-5-carboxamide?
The canonical SMILES for N-propyl-2,5-dihydro-1,2-oxazole-5-carboxamide is CCCNC(=O)C1C=CNO1.
What is the InChIKey of N-propyl-2,5-dihydro-1,2-oxazole-5-carboxamide?
The InChIKey is WPOAACQRXNXSQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O2/c1-2-4-8-7(10)6-3-5-9-11-6/h3,5-6,9H,2,4H2,1H3,(H,8,10).
What are the key properties of N-propyl-2,5-dihydro-1,2-oxazole-5-carboxamide?
N-propyl-2,5-dihydro-1,2-oxazole-5-carboxamide has a molecular weight of 156.19 g/mol, XLogP of -0.07, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-2,5-dihydro-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 143180198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).