2-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]acetamide;hydrochloride

C10H18ClN3O2 — CID 119344945

IUPAC2-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]acetamide;hydrochloride
SMILESCCc1noc(CC)c1CNC(=O)CN.Cl
InChIInChI=1S/C10H17N3O2.ClH/c1-3-8-7(6-12-10(14)5-11)9(4-2)15-13-8;/h3-6,11H2,1-2H3,(H,12,14);1H
InChIKeyIACQXIYNZMLXJI-UHFFFAOYSA-N
MW247.73 g/mol
LogP0.80
Rot. Bonds5

About 2-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]acetamide;hydrochloride

2-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]acetamide;hydrochloride (PubChem CID 119344945) has the molecular formula C10H18ClN3O2 and a molecular weight of 247.73 g/mol. Its IUPAC name is 2-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]acetamide;hydrochloride
PubChem CID119344945
Molecular FormulaC10H18ClN3O2
Molecular Weight247.73 g/mol
Exact Mass247.11
IUPAC Name2-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]acetamide;hydrochloride
SMILESCCc1noc(CC)c1CNC(=O)CN.Cl
InChIInChI=1S/C10H17N3O2.ClH/c1-3-8-7(6-12-10(14)5-11)9(4-2)15-13-8;/h3-6,11H2,1-2H3,(H,12,14);1H
InChIKeyIACQXIYNZMLXJI-UHFFFAOYSA-N
XLogP0.80
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.73
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(cyclohex-1-en-1-yl)ethyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide
CID 1245261
N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-butyl-3-ethyl-5-methyl-1,2-oxazole-4-carboxamide
CID 24982741
N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N,3-diethyl-5-methyl-1,2-oxazole-4-carboxamide
CID 24982677
N-[6-amino-1-(2-methylpropyl)-2,4-dioxopyrimidin-5-yl]-N-butyl-3-ethyl-5-methyl-1,2-oxazole-4-carboxamide
CID 25163169
(3-Ethyl-5-methylisoxazol-4-yl)(pyrrolidin-1-yl)methanone
CID 1245980
4-Isoxazolemethanamine, 3,5-diethyl-
CID 71755768
1-(Dimethyl-1,2-oxazol-4-yl)propan-1-amine
CID 71757345
N-(2-(Dimethylamino)ethyl)-3-ethyl-5-methylisoxazole-4-carboxamide
CID 1245014
N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-3-ethyl-5-methyl-N-(3-methylbutyl)-1,2-oxazole-4-carboxamide
CID 18190985
N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-3-ethyl-5-methyl-N-(2-methylpropyl)-1,2-oxazole-4-carboxamide
CID 24687405
N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-3-ethyl-5-methyl-1,2-oxazole-4-carboxamide
CID 24687502
3-methyl-N-[3-(2-oxoazepan-1-yl)propyl]-5-propan-2-yl-1,2-oxazole-4-carboxamide
CID 30478640

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]acetamide;hydrochloride?
The IUPAC name of 2-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]acetamide;hydrochloride (CID 119344945) is 2-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]acetamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]acetamide;hydrochloride?
The canonical SMILES for 2-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]acetamide;hydrochloride is CCc1noc(CC)c1CNC(=O)CN.Cl.
What is the InChIKey of 2-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]acetamide;hydrochloride?
The InChIKey is IACQXIYNZMLXJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2.ClH/c1-3-8-7(6-12-10(14)5-11)9(4-2)15-13-8;/h3-6,11H2,1-2H3,(H,12,14);1H.
What are the key properties of 2-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]acetamide;hydrochloride?
2-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]acetamide;hydrochloride has a molecular weight of 247.73 g/mol, XLogP of 0.80, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(3,5-diethyl-1,2-oxazol-4-yl)methyl]acetamide;hydrochloride is sourced from PubChem (CID 119344945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).