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

C8H12N2O — CID 60712181

IUPACN-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanamine
SMILESCc1cc(CNC2CC2)on1
InChIInChI=1S/C8H12N2O/c1-6-4-8(11-10-6)5-9-7-2-3-7/h4,7,9H,2-3,5H2,1H3
InChIKeyRQVVEVPTKUEVCY-UHFFFAOYSA-N
MW152.20 g/mol
LogP1.24
Rot. Bonds3

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

N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanamine (PubChem CID 60712181) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanamine
PubChem CID60712181
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC NameN-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanamine
SMILESCc1cc(CNC2CC2)on1
InChIInChI=1S/C8H12N2O/c1-6-4-8(11-10-6)5-9-7-2-3-7/h4,7,9H,2-3,5H2,1H3
InChIKeyRQVVEVPTKUEVCY-UHFFFAOYSA-N
XLogP1.24
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-dimethyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-1,3-dioxan-5-amine
CID 106658722
N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-4-methylcyclohexan-1-amine
CID 115654524
2-ethyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopentan-1-amine
CID 115717519
2,4-dimethyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclohexan-1-amine
CID 64761102
1-benzyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]pyrrolidin-3-amine
CID 60713870
N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2-pyrrolidin-2-ylcyclohexan-1-amine
CID 79549657
2-fluoro-N-[(3-methyl-1,2-oxazol-5-yl)methyl]oxan-3-amine
CID 126857076
1-cyclopropyl-2-methyl-3-[(3-methyl-1,2-oxazol-5-yl)methyl]guanidine;hydroiodide
CID 119114659
N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine
CID 79545774
N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanecarboxamide
CID 53017058
N-[(3-methoxy-1,2-oxazol-5-yl)methyl]cyclohexanamine
CID 126837976
1-cyclopropyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]propan-2-amine
CID 115717515

Frequently Asked Questions

What is the IUPAC name of N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanamine?
The IUPAC name of N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanamine (CID 60712181) is N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanamine.
What is the SMILES notation for N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanamine?
The canonical SMILES for N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanamine is Cc1cc(CNC2CC2)on1.
What is the InChIKey of N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanamine?
The InChIKey is RQVVEVPTKUEVCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c1-6-4-8(11-10-6)5-9-7-2-3-7/h4,7,9H,2-3,5H2,1H3.
What are the key properties of N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanamine?
N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanamine has a molecular weight of 152.20 g/mol, XLogP of 1.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanamine is sourced from PubChem (CID 60712181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).