[3-methyl-5-(oxan-2-yl)-1,2-oxazol-4-yl]methanamine

C10H16N2O2 — CID 105449979

IUPAC[3-methyl-5-(oxan-2-yl)-1,2-oxazol-4-yl]methanamine
SMILESCc1noc(C2CCCCO2)c1CN
InChIInChI=1S/C10H16N2O2/c1-7-8(6-11)10(14-12-7)9-4-2-3-5-13-9/h9H,2-6,11H2,1H3
InChIKeyNLGSCLMRFJHCHU-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.68
Rot. Bonds2

About [3-methyl-5-(oxan-2-yl)-1,2-oxazol-4-yl]methanamine

[3-methyl-5-(oxan-2-yl)-1,2-oxazol-4-yl]methanamine (PubChem CID 105449979) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is [3-methyl-5-(oxan-2-yl)-1,2-oxazol-4-yl]methanamine.

Molecular Properties

Compound Name[3-methyl-5-(oxan-2-yl)-1,2-oxazol-4-yl]methanamine
PubChem CID105449979
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name[3-methyl-5-(oxan-2-yl)-1,2-oxazol-4-yl]methanamine
SMILESCc1noc(C2CCCCO2)c1CN
InChIInChI=1S/C10H16N2O2/c1-7-8(6-11)10(14-12-7)9-4-2-3-5-13-9/h9H,2-6,11H2,1H3
InChIKeyNLGSCLMRFJHCHU-UHFFFAOYSA-N
XLogP1.68
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [3-methyl-5-(oxan-2-yl)-1,2-oxazol-4-yl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(5-cycloheptyl-3-methyl-1,2-oxazol-4-yl)methanamine
CID 105462134
4-ethyl-5-(oxan-2-yl)-1,2-oxazole-3-carboxylic acid
CID 105482844
[5-(1,1-dioxothiolan-3-yl)-3-methyl-1,2-oxazol-4-yl]methanamine
CID 105488145
2-(5-cyclopentyl-3-methyl-1,2-oxazol-4-yl)acetic acid
CID 105462752
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methyl-N-[[(2R)-oxan-2-yl]methyl]acetamide
CID 97313614
[5-(oxan-2-yl)-1,2-oxazol-3-yl]methanol
CID 115094067
[3,5-dimethyl-1-(oxolan-2-ylmethyl)pyrazol-4-yl]methanamine
CID 62550168
5-(oxan-2-yl)-1,2-oxazol-3-amine
CID 105433771
2-[3-methyl-5-(1-methylpyrrolidin-2-yl)-1,2-oxazol-4-yl]ethanamine
CID 105463249
5-ethyl-6-methyl-2-(oxolan-2-yl)pyrimidin-4-amine
CID 65328606
[4,6-dimethyl-2-(1,4-oxathian-2-yl)pyrimidin-5-yl]methanamine
CID 79970551
[4-(oxan-2-yl)-3-pyridinyl]methanamine
CID 115019133

Frequently Asked Questions

What is the IUPAC name of [3-methyl-5-(oxan-2-yl)-1,2-oxazol-4-yl]methanamine?
The IUPAC name of [3-methyl-5-(oxan-2-yl)-1,2-oxazol-4-yl]methanamine (CID 105449979) is [3-methyl-5-(oxan-2-yl)-1,2-oxazol-4-yl]methanamine.
What is the SMILES notation for [3-methyl-5-(oxan-2-yl)-1,2-oxazol-4-yl]methanamine?
The canonical SMILES for [3-methyl-5-(oxan-2-yl)-1,2-oxazol-4-yl]methanamine is Cc1noc(C2CCCCO2)c1CN.
What is the InChIKey of [3-methyl-5-(oxan-2-yl)-1,2-oxazol-4-yl]methanamine?
The InChIKey is NLGSCLMRFJHCHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-7-8(6-11)10(14-12-7)9-4-2-3-5-13-9/h9H,2-6,11H2,1H3.
What are the key properties of [3-methyl-5-(oxan-2-yl)-1,2-oxazol-4-yl]methanamine?
[3-methyl-5-(oxan-2-yl)-1,2-oxazol-4-yl]methanamine has a molecular weight of 196.25 g/mol, XLogP of 1.68, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methyl-5-(oxan-2-yl)-1,2-oxazol-4-yl]methanamine is sourced from PubChem (CID 105449979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).