2-(5-tert-butyl-1,3-oxazol-2-yl)ethanamine;hydrochloride

C9H17ClN2O — CID 68754663

IUPAC2-(5-tert-butyl-1,3-oxazol-2-yl)ethanamine;hydrochloride
SMILESCC(C)(C)c1cnc(CCN)o1.Cl
InChIInChI=1S/C9H16N2O.ClH/c1-9(2,3)7-6-11-8(12-7)4-5-10;/h6H,4-5,10H2,1-3H3;1H
InChIKeyUYEBLECHPNAUEM-UHFFFAOYSA-N
MW204.70 g/mol
LogP1.90
Rot. Bonds2

About 2-(5-tert-butyl-1,3-oxazol-2-yl)ethanamine;hydrochloride

2-(5-tert-butyl-1,3-oxazol-2-yl)ethanamine;hydrochloride (PubChem CID 68754663) has the molecular formula C9H17ClN2O and a molecular weight of 204.70 g/mol. Its IUPAC name is 2-(5-tert-butyl-1,3-oxazol-2-yl)ethanamine;hydrochloride.

Molecular Properties

Compound Name2-(5-tert-butyl-1,3-oxazol-2-yl)ethanamine;hydrochloride
PubChem CID68754663
Molecular FormulaC9H17ClN2O
Molecular Weight204.70 g/mol
Exact Mass204.10
IUPAC Name2-(5-tert-butyl-1,3-oxazol-2-yl)ethanamine;hydrochloride
SMILESCC(C)(C)c1cnc(CCN)o1.Cl
InChIInChI=1S/C9H16N2O.ClH/c1-9(2,3)7-6-11-8(12-7)4-5-10;/h6H,4-5,10H2,1-3H3;1H
InChIKeyUYEBLECHPNAUEM-UHFFFAOYSA-N
XLogP1.90
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.70
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-ethyl-1,3-oxazol-2-yl)ethanamine;hydrochloride
CID 66588553
2-[5-(2,3,3-trimethylbutyl)-1,3-oxazol-2-yl]ethanamine
CID 65178751
2-(5-propyl-1,3-oxazol-2-yl)ethanamine
CID 65178585
[5-(2-methylbutan-2-yl)-1,3-oxazol-2-yl]methanamine
CID 65178786
2-(5-tert-butyl-1,3-oxazol-2-yl)acetonitrile
CID 82414888
2-[5-(5-tert-butyl-2-methylphenyl)-1,3-oxazol-2-yl]ethanamine
CID 82049649
5-tert-butyl-2-[2-methyl-2-(4-methylthiadiazol-5-yl)propyl]-1,3-oxazole
CID 170282735
[4-[(5-tert-butyl-1,3-oxazol-2-yl)methoxy]phenyl]methanamine
CID 106484934
[5-(2-fluoropropan-2-yl)-1,3-oxazol-2-yl]methanamine
CID 84764000
2-(5-pentan-2-yl-1,3-oxazol-2-yl)ethanamine
CID 65179243
2-[3-[(5-tert-butyl-1,3-oxazol-2-yl)methylsulfanyl]-5-methyl-1,2,4-triazol-4-yl]ethanamine
CID 65299071
2-[5-(3-methylcyclobutyl)-1,3-oxazol-2-yl]ethanamine
CID 164660372

Frequently Asked Questions

What is the IUPAC name of 2-(5-tert-butyl-1,3-oxazol-2-yl)ethanamine;hydrochloride?
The IUPAC name of 2-(5-tert-butyl-1,3-oxazol-2-yl)ethanamine;hydrochloride (CID 68754663) is 2-(5-tert-butyl-1,3-oxazol-2-yl)ethanamine;hydrochloride.
What is the SMILES notation for 2-(5-tert-butyl-1,3-oxazol-2-yl)ethanamine;hydrochloride?
The canonical SMILES for 2-(5-tert-butyl-1,3-oxazol-2-yl)ethanamine;hydrochloride is CC(C)(C)c1cnc(CCN)o1.Cl.
What is the InChIKey of 2-(5-tert-butyl-1,3-oxazol-2-yl)ethanamine;hydrochloride?
The InChIKey is UYEBLECHPNAUEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O.ClH/c1-9(2,3)7-6-11-8(12-7)4-5-10;/h6H,4-5,10H2,1-3H3;1H.
What are the key properties of 2-(5-tert-butyl-1,3-oxazol-2-yl)ethanamine;hydrochloride?
2-(5-tert-butyl-1,3-oxazol-2-yl)ethanamine;hydrochloride has a molecular weight of 204.70 g/mol, XLogP of 1.90, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-tert-butyl-1,3-oxazol-2-yl)ethanamine;hydrochloride is sourced from PubChem (CID 68754663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).