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

C9H14N2O — CID 103275583

IUPAC1-cyclopropyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]methanamine
SMILESCc1cnc(CNCC2CC2)o1
InChIInChI=1S/C9H14N2O/c1-7-4-11-9(12-7)6-10-5-8-2-3-8/h4,8,10H,2-3,5-6H2,1H3
InChIKeyDJZZUVRSOQNYQH-UHFFFAOYSA-N
MW166.22 g/mol
LogP1.48
Rot. Bonds4

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

1-cyclopropyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]methanamine (PubChem CID 103275583) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]methanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]methanamine
PubChem CID103275583
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name1-cyclopropyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]methanamine
SMILESCc1cnc(CNCC2CC2)o1
InChIInChI=1S/C9H14N2O/c1-7-4-11-9(12-7)6-10-5-8-2-3-8/h4,8,10H,2-3,5-6H2,1H3
InChIKeyDJZZUVRSOQNYQH-UHFFFAOYSA-N
XLogP1.48
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-(oxolan-3-yl)methanamine
CID 106369698
4-ethyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]cyclohexan-1-amine
CID 103275539
1-(2-bicyclo[2.2.1]heptanyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]methanamine
CID 103275478
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-(1-methylpiperidin-2-yl)methanamine
CID 106369735
2-methoxy-N-[(5-methyl-1,3-oxazol-2-yl)methyl]ethanamine
CID 65181879
3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propan-1-ol
CID 106371738
2-[(5-methyl-1,3-oxazol-2-yl)methylamino]acetic acid
CID 106372016
tert-butyl 3-[[(5-methyl-1,3-oxazol-2-yl)methylamino]methyl]piperidine-1-carboxylate
CID 103275614
N'-hydroxy-2-[(5-methyl-1,3-oxazol-2-yl)methylamino]ethanimidamide
CID 106372811
2-ethoxy-N-[(5-methyl-1,3-oxazol-2-yl)methyl]ethanamine
CID 106372226
3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propane-1,2-diol
CID 106371905
2-(cyclobutylmethyl)-5-methyl-1,3-oxazole
CID 119055129

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]methanamine?
The IUPAC name of 1-cyclopropyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]methanamine (CID 103275583) is 1-cyclopropyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]methanamine.
What is the SMILES notation for 1-cyclopropyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]methanamine?
The canonical SMILES for 1-cyclopropyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]methanamine is Cc1cnc(CNCC2CC2)o1.
What is the InChIKey of 1-cyclopropyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]methanamine?
The InChIKey is DJZZUVRSOQNYQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-7-4-11-9(12-7)6-10-5-8-2-3-8/h4,8,10H,2-3,5-6H2,1H3.
What are the key properties of 1-cyclopropyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]methanamine?
1-cyclopropyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]methanamine has a molecular weight of 166.22 g/mol, XLogP of 1.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]methanamine is sourced from PubChem (CID 103275583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).