2-(methylamino)-N-[[5-(methylamino)-1,3-oxazol-2-yl]methyl]acetamide

C8H14N4O2 — CID 58719952

IUPAC2-(methylamino)-N-[[5-(methylamino)-1,3-oxazol-2-yl]methyl]acetamide
SMILESCNCC(=O)NCc1ncc(NC)o1
InChIInChI=1S/C8H14N4O2/c1-9-3-6(13)11-5-8-12-4-7(10-2)14-8/h4,9-10H,3,5H2,1-2H3,(H,11,13)
InChIKeyMRXHNOOVYLGUSK-UHFFFAOYSA-N
MW198.23 g/mol
LogP-0.45
Rot. Bonds5

About 2-(methylamino)-N-[[5-(methylamino)-1,3-oxazol-2-yl]methyl]acetamide

2-(methylamino)-N-[[5-(methylamino)-1,3-oxazol-2-yl]methyl]acetamide (PubChem CID 58719952) has the molecular formula C8H14N4O2 and a molecular weight of 198.23 g/mol. Its IUPAC name is 2-(methylamino)-N-[[5-(methylamino)-1,3-oxazol-2-yl]methyl]acetamide.

Molecular Properties

Compound Name2-(methylamino)-N-[[5-(methylamino)-1,3-oxazol-2-yl]methyl]acetamide
PubChem CID58719952
Molecular FormulaC8H14N4O2
Molecular Weight198.23 g/mol
Exact Mass198.11
IUPAC Name2-(methylamino)-N-[[5-(methylamino)-1,3-oxazol-2-yl]methyl]acetamide
SMILESCNCC(=O)NCc1ncc(NC)o1
InChIInChI=1S/C8H14N4O2/c1-9-3-6(13)11-5-8-12-4-7(10-2)14-8/h4,9-10H,3,5H2,1-2H3,(H,11,13)
InChIKeyMRXHNOOVYLGUSK-UHFFFAOYSA-N
XLogP-0.45
TPSA79.19 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.23
LogP ≤ 5-0.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

tert-butyl N-(2-methyl-1,3-oxazol-5-yl)carbamate
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2-(Trifluoromethyl)-1,3-oxazol-5-amine
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N,N,2-Trimethyloxazol-5-amine
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2-(Fluoromethyl)-1,3-oxazol-5-amine
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2-(Difluoromethyl)-1,3-oxazol-5-amine
CID 84762382
2-(2-Fluoropropan-2-yl)-1,3-oxazol-5-amine
CID 84762829
2-methyl-N-(2,2,2-trifluoroethyl)-1,3-oxazol-5-amine
CID 153684328
N-[bis(diethoxyphosphoryl)methyl]-2-methyl-1,3-oxazol-5-amine
CID 56926046
4-(2-Methyloxazol-5-yl)morpholine
CID 13179057
N-(1,3-oxazol-2-ylmethyl)-2-oxoacetamide
CID 21031069
N-Methyl-1-(oxazol-2-YL)methanamine
CID 21255525

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-[[5-(methylamino)-1,3-oxazol-2-yl]methyl]acetamide?
The IUPAC name of 2-(methylamino)-N-[[5-(methylamino)-1,3-oxazol-2-yl]methyl]acetamide (CID 58719952) is 2-(methylamino)-N-[[5-(methylamino)-1,3-oxazol-2-yl]methyl]acetamide.
What is the SMILES notation for 2-(methylamino)-N-[[5-(methylamino)-1,3-oxazol-2-yl]methyl]acetamide?
The canonical SMILES for 2-(methylamino)-N-[[5-(methylamino)-1,3-oxazol-2-yl]methyl]acetamide is CNCC(=O)NCc1ncc(NC)o1.
What is the InChIKey of 2-(methylamino)-N-[[5-(methylamino)-1,3-oxazol-2-yl]methyl]acetamide?
The InChIKey is MRXHNOOVYLGUSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O2/c1-9-3-6(13)11-5-8-12-4-7(10-2)14-8/h4,9-10H,3,5H2,1-2H3,(H,11,13).
What are the key properties of 2-(methylamino)-N-[[5-(methylamino)-1,3-oxazol-2-yl]methyl]acetamide?
2-(methylamino)-N-[[5-(methylamino)-1,3-oxazol-2-yl]methyl]acetamide has a molecular weight of 198.23 g/mol, XLogP of -0.45, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-[[5-(methylamino)-1,3-oxazol-2-yl]methyl]acetamide is sourced from PubChem (CID 58719952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).