(5-ethyl-1,3-oxazol-4-yl)methanamine;hydrochloride

C6H11ClN2O — CID 170912231

IUPAC(5-ethyl-1,3-oxazol-4-yl)methanamine;hydrochloride
SMILESCCc1ocnc1CN.Cl
InChIInChI=1S/C6H10N2O.ClH/c1-2-6-5(3-7)8-4-9-6;/h4H,2-3,7H2,1H3;1H
InChIKeyRVPQFDYZKKLFFX-UHFFFAOYSA-N
MW162.62 g/mol
LogP1.12
Rot. Bonds2

About (5-ethyl-1,3-oxazol-4-yl)methanamine;hydrochloride

(5-ethyl-1,3-oxazol-4-yl)methanamine;hydrochloride (PubChem CID 170912231) has the molecular formula C6H11ClN2O and a molecular weight of 162.62 g/mol. Its IUPAC name is (5-ethyl-1,3-oxazol-4-yl)methanamine;hydrochloride.

Molecular Properties

Compound Name(5-ethyl-1,3-oxazol-4-yl)methanamine;hydrochloride
PubChem CID170912231
Molecular FormulaC6H11ClN2O
Molecular Weight162.62 g/mol
Exact Mass162.06
IUPAC Name(5-ethyl-1,3-oxazol-4-yl)methanamine;hydrochloride
SMILESCCc1ocnc1CN.Cl
InChIInChI=1S/C6H10N2O.ClH/c1-2-6-5(3-7)8-4-9-6;/h4H,2-3,7H2,1H3;1H
InChIKeyRVPQFDYZKKLFFX-UHFFFAOYSA-N
XLogP1.12
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.62
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-Ethyl-4-methyloxazole
CID 207286
(5-Methyl-1,3-oxazol-4-yl)methanamine
CID 57885769
(5-Cyclopropyl-1,3-oxazol-4-yl)methanamine hydrochloride
CID 137971658
1-(4-Methyl-1,3-oxazol-5-yl)methanamine hydrochloride
CID 132344081
4,5,6,7-Tetrahydrooxazolo(4,5-c)pyridine
CID 55263451
[5-(Trifluoromethyl)-1,3-oxazol-4-yl]methanamine hydrochloride
CID 137919901
1-(5-Methyl-1,3-oxazol-4-yl)methanamine hydrochloride
CID 72212391
1-(4-Ethyl-1,3-oxazol-5-yl)methanamine dihydrochloride
CID 165945971
(4-Methyl-1,3-oxazol-5-yl)methylamine
CID 22708194
2-(4,4-Difluoropiperidin-1-yl)-2-(4-methyl-1,3-oxazol-5-yl)ethanamine
CID 118297302
2-(4-Fluoro-4-phosphanylpiperidin-1-yl)-2-(4-methyl-1,3-oxazol-5-yl)ethanamine
CID 134404958
N-[(5-ethyl-1,3-oxazol-4-yl)methyl]-2,2,2-trifluoroethanamine
CID 166789291

Frequently Asked Questions

What is the IUPAC name of (5-ethyl-1,3-oxazol-4-yl)methanamine;hydrochloride?
The IUPAC name of (5-ethyl-1,3-oxazol-4-yl)methanamine;hydrochloride (CID 170912231) is (5-ethyl-1,3-oxazol-4-yl)methanamine;hydrochloride.
What is the SMILES notation for (5-ethyl-1,3-oxazol-4-yl)methanamine;hydrochloride?
The canonical SMILES for (5-ethyl-1,3-oxazol-4-yl)methanamine;hydrochloride is CCc1ocnc1CN.Cl.
What is the InChIKey of (5-ethyl-1,3-oxazol-4-yl)methanamine;hydrochloride?
The InChIKey is RVPQFDYZKKLFFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O.ClH/c1-2-6-5(3-7)8-4-9-6;/h4H,2-3,7H2,1H3;1H.
What are the key properties of (5-ethyl-1,3-oxazol-4-yl)methanamine;hydrochloride?
(5-ethyl-1,3-oxazol-4-yl)methanamine;hydrochloride has a molecular weight of 162.62 g/mol, XLogP of 1.12, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-ethyl-1,3-oxazol-4-yl)methanamine;hydrochloride is sourced from PubChem (CID 170912231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).