N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]formamide

C7H10N2O2 — CID 106389909

IUPACN-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]formamide
SMILESCc1cnc(C(C)NC=O)o1
InChIInChI=1S/C7H10N2O2/c1-5-3-8-7(11-5)6(2)9-4-10/h3-4,6H,1-2H3,(H,9,10)
InChIKeyKZGHJTGEZPIEDK-UHFFFAOYSA-N
MW154.17 g/mol
LogP0.79
Rot. Bonds3

About N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]formamide

N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]formamide (PubChem CID 106389909) has the molecular formula C7H10N2O2 and a molecular weight of 154.17 g/mol. Its IUPAC name is N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]formamide.

Molecular Properties

Compound NameN-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]formamide
PubChem CID106389909
Molecular FormulaC7H10N2O2
Molecular Weight154.17 g/mol
Exact Mass154.07
IUPAC NameN-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]formamide
SMILESCc1cnc(C(C)NC=O)o1
InChIInChI=1S/C7H10N2O2/c1-5-3-8-7(11-5)6(2)9-4-10/h3-4,6H,1-2H3,(H,9,10)
InChIKeyKZGHJTGEZPIEDK-UHFFFAOYSA-N
XLogP0.79
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]formamide?
The IUPAC name of N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]formamide (CID 106389909) is N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]formamide.
What is the SMILES notation for N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]formamide?
The canonical SMILES for N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]formamide is Cc1cnc(C(C)NC=O)o1.
What is the InChIKey of N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]formamide?
The InChIKey is KZGHJTGEZPIEDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2/c1-5-3-8-7(11-5)6(2)9-4-10/h3-4,6H,1-2H3,(H,9,10).
What are the key properties of N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]formamide?
N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]formamide has a molecular weight of 154.17 g/mol, XLogP of 0.79, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]formamide is sourced from PubChem (CID 106389909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).