N-methyl-1-(2-morpholin-4-yl-1,3-oxazol-5-yl)methanamine

C9H15N3O2 — CID 112713065

IUPACN-methyl-1-(2-morpholin-4-yl-1,3-oxazol-5-yl)methanamine
SMILESCNCc1cnc(N2CCOCC2)o1
InChIInChI=1S/C9H15N3O2/c1-10-6-8-7-11-9(14-8)12-2-4-13-5-3-12/h7,10H,2-6H2,1H3
InChIKeyYVLAVILYZHJIAW-UHFFFAOYSA-N
MW197.24 g/mol
LogP0.23
Rot. Bonds3

About N-methyl-1-(2-morpholin-4-yl-1,3-oxazol-5-yl)methanamine

N-methyl-1-(2-morpholin-4-yl-1,3-oxazol-5-yl)methanamine (PubChem CID 112713065) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is N-methyl-1-(2-morpholin-4-yl-1,3-oxazol-5-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(2-morpholin-4-yl-1,3-oxazol-5-yl)methanamine
PubChem CID112713065
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC NameN-methyl-1-(2-morpholin-4-yl-1,3-oxazol-5-yl)methanamine
SMILESCNCc1cnc(N2CCOCC2)o1
InChIInChI=1S/C9H15N3O2/c1-10-6-8-7-11-9(14-8)12-2-4-13-5-3-12/h7,10H,2-6H2,1H3
InChIKeyYVLAVILYZHJIAW-UHFFFAOYSA-N
XLogP0.23
TPSA50.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 50.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-morpholin-4-yl-1,3-oxazol-5-yl)methanamine?
The IUPAC name of N-methyl-1-(2-morpholin-4-yl-1,3-oxazol-5-yl)methanamine (CID 112713065) is N-methyl-1-(2-morpholin-4-yl-1,3-oxazol-5-yl)methanamine.
What is the SMILES notation for N-methyl-1-(2-morpholin-4-yl-1,3-oxazol-5-yl)methanamine?
The canonical SMILES for N-methyl-1-(2-morpholin-4-yl-1,3-oxazol-5-yl)methanamine is CNCc1cnc(N2CCOCC2)o1.
What is the InChIKey of N-methyl-1-(2-morpholin-4-yl-1,3-oxazol-5-yl)methanamine?
The InChIKey is YVLAVILYZHJIAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-10-6-8-7-11-9(14-8)12-2-4-13-5-3-12/h7,10H,2-6H2,1H3.
What are the key properties of N-methyl-1-(2-morpholin-4-yl-1,3-oxazol-5-yl)methanamine?
N-methyl-1-(2-morpholin-4-yl-1,3-oxazol-5-yl)methanamine has a molecular weight of 197.24 g/mol, XLogP of 0.23, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-morpholin-4-yl-1,3-oxazol-5-yl)methanamine is sourced from PubChem (CID 112713065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).