N-(2-aminoethyl)-2-(4-methyl-1,3-oxazol-2-yl)acetamide

C8H13N3O2 — CID 83617653

IUPACN-(2-aminoethyl)-2-(4-methyl-1,3-oxazol-2-yl)acetamide
SMILESCc1coc(CC(=O)NCCN)n1
InChIInChI=1S/C8H13N3O2/c1-6-5-13-8(11-6)4-7(12)10-3-2-9/h5H,2-4,9H2,1H3,(H,10,12)
InChIKeyDPSDYGDOXXXPFY-UHFFFAOYSA-N
MW183.21 g/mol
LogP-0.40
Rot. Bonds4

About N-(2-aminoethyl)-2-(4-methyl-1,3-oxazol-2-yl)acetamide

N-(2-aminoethyl)-2-(4-methyl-1,3-oxazol-2-yl)acetamide (PubChem CID 83617653) has the molecular formula C8H13N3O2 and a molecular weight of 183.21 g/mol. Its IUPAC name is N-(2-aminoethyl)-2-(4-methyl-1,3-oxazol-2-yl)acetamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-2-(4-methyl-1,3-oxazol-2-yl)acetamide
PubChem CID83617653
Molecular FormulaC8H13N3O2
Molecular Weight183.21 g/mol
Exact Mass183.10
IUPAC NameN-(2-aminoethyl)-2-(4-methyl-1,3-oxazol-2-yl)acetamide
SMILESCc1coc(CC(=O)NCCN)n1
InChIInChI=1S/C8H13N3O2/c1-6-5-13-8(11-6)4-7(12)10-3-2-9/h5H,2-4,9H2,1H3,(H,10,12)
InChIKeyDPSDYGDOXXXPFY-UHFFFAOYSA-N
XLogP-0.40
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 5-0.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-methyl-1,3-oxazol-2-yl)propan-2-one
CID 82593984
N-(2-aminoethyl)-4-methyl-1,2-oxazole-3-carboxamide
CID 83617532
N-(2-aminoethyl)-3-methyl-1,2-oxazole-4-carboxamide
CID 83617546
4-(4-methyl-1,3-oxazol-2-yl)butan-2-one
CID 82416947
2-[methyl-[2-(4-methyl-1,3-oxazol-2-yl)acetyl]amino]acetic acid
CID 110836146
N-(3-aminopropyl)-2-methyl-1,3-oxazole-4-carboxamide
CID 121209358
3-amino-4-(4-methyl-1,3-oxazol-2-yl)butan-2-one
CID 82413377
3-N-[(4-methyl-1,3-oxazol-2-yl)methyl]benzene-1,3-dicarboxamide
CID 140556514
2-(2-aminoethyl)-N-(2-methoxyethyl)-1,3-oxazole-4-carboxamide
CID 3858413
2-methyl-3-[(4-methyl-1,3-oxazole-2-carbonyl)amino]propanoic acid
CID 110835158
N-(2-aminoethyl)-2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide
CID 82496271
N-(3-aminopropyl)-2-(3-methyl-1,2-oxazol-4-yl)acetamide
CID 83617752

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-2-(4-methyl-1,3-oxazol-2-yl)acetamide?
The IUPAC name of N-(2-aminoethyl)-2-(4-methyl-1,3-oxazol-2-yl)acetamide (CID 83617653) is N-(2-aminoethyl)-2-(4-methyl-1,3-oxazol-2-yl)acetamide.
What is the SMILES notation for N-(2-aminoethyl)-2-(4-methyl-1,3-oxazol-2-yl)acetamide?
The canonical SMILES for N-(2-aminoethyl)-2-(4-methyl-1,3-oxazol-2-yl)acetamide is Cc1coc(CC(=O)NCCN)n1.
What is the InChIKey of N-(2-aminoethyl)-2-(4-methyl-1,3-oxazol-2-yl)acetamide?
The InChIKey is DPSDYGDOXXXPFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O2/c1-6-5-13-8(11-6)4-7(12)10-3-2-9/h5H,2-4,9H2,1H3,(H,10,12).
What are the key properties of N-(2-aminoethyl)-2-(4-methyl-1,3-oxazol-2-yl)acetamide?
N-(2-aminoethyl)-2-(4-methyl-1,3-oxazol-2-yl)acetamide has a molecular weight of 183.21 g/mol, XLogP of -0.40, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-2-(4-methyl-1,3-oxazol-2-yl)acetamide is sourced from PubChem (CID 83617653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).