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

C6H8N2O3 — CID 54379071

IUPACN-[(3-methoxy-1,2-oxazol-5-yl)methyl]formamide
SMILESCOc1cc(CNC=O)on1
InChIInChI=1S/C6H8N2O3/c1-10-6-2-5(11-8-6)3-7-4-9/h2,4H,3H2,1H3,(H,7,9)
InChIKeyGQMQDROBGDCXCJ-UHFFFAOYSA-N
MW156.14 g/mol
LogP-0.07
Rot. Bonds4

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

N-[(3-methoxy-1,2-oxazol-5-yl)methyl]formamide (PubChem CID 54379071) has the molecular formula C6H8N2O3 and a molecular weight of 156.14 g/mol. Its IUPAC name is N-[(3-methoxy-1,2-oxazol-5-yl)methyl]formamide.

Molecular Properties

Compound NameN-[(3-methoxy-1,2-oxazol-5-yl)methyl]formamide
PubChem CID54379071
Molecular FormulaC6H8N2O3
Molecular Weight156.14 g/mol
Exact Mass156.05
IUPAC NameN-[(3-methoxy-1,2-oxazol-5-yl)methyl]formamide
SMILESCOc1cc(CNC=O)on1
InChIInChI=1S/C6H8N2O3/c1-10-6-2-5(11-8-6)3-7-4-9/h2,4H,3H2,1H3,(H,7,9)
InChIKeyGQMQDROBGDCXCJ-UHFFFAOYSA-N
XLogP-0.07
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.14
LogP ≤ 5-0.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(2-Methoxy-ethyl)-[3-(3-piperidin-1-yl-propoxy)-isoxazol-5-ylmethyl]-amine
CID 11666530
3-Methoxy-5-isoxazolemethanamine
CID 2763227
3-methoxy-N-(2,2,2-trifluoroethyl)isoxazole-5-carboxamide
CID 71802478
2-ethyl-N-[(3-methoxy-1,2-oxazol-5-yl)methyl]-6-methylmorpholine-4-carboxamide
CID 132314926
N'-[[3-(trifluoromethoxy)-1,2-oxazol-5-yl]methyl]ethane-1,2-diamine
CID 70458636
[5-(Aminomethyl)-1,2-oxazol-3-yl] carbamate;hydrochloride
CID 17935537
[5-(Aminomethyl)-1,2-oxazol-3-yl] carbamate
CID 17935538
1-N'-[(5-methyl-1,2-oxazol-3-yl)oxymethyl]ethane-1,1-diamine
CID 20589476
(3-Methoxyisoxazol-5-yl)methanamine hydrochloride
CID 21292276
Ethyl [5-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-1,2-oxazol-3-yl] carbonate
CID 21694578
3-methoxy-N-methylisoxazole-5-carboxamide
CID 45099122
N-[(3-methoxy-1,2-oxazol-5-yl)methyl]acetamide
CID 59223456

Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxy-1,2-oxazol-5-yl)methyl]formamide?
The IUPAC name of N-[(3-methoxy-1,2-oxazol-5-yl)methyl]formamide (CID 54379071) is N-[(3-methoxy-1,2-oxazol-5-yl)methyl]formamide.
What is the SMILES notation for N-[(3-methoxy-1,2-oxazol-5-yl)methyl]formamide?
The canonical SMILES for N-[(3-methoxy-1,2-oxazol-5-yl)methyl]formamide is COc1cc(CNC=O)on1.
What is the InChIKey of N-[(3-methoxy-1,2-oxazol-5-yl)methyl]formamide?
The InChIKey is GQMQDROBGDCXCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O3/c1-10-6-2-5(11-8-6)3-7-4-9/h2,4H,3H2,1H3,(H,7,9).
What are the key properties of N-[(3-methoxy-1,2-oxazol-5-yl)methyl]formamide?
N-[(3-methoxy-1,2-oxazol-5-yl)methyl]formamide has a molecular weight of 156.14 g/mol, XLogP of -0.07, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxy-1,2-oxazol-5-yl)methyl]formamide is sourced from PubChem (CID 54379071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).