2-amino-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-N-methylacetamide

C10H17N3OS — CID 119881804

IUPAC2-amino-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-N-methylacetamide
SMILESCc1nc(C)c(C(C)N(C)C(=O)CN)s1
InChIInChI=1S/C10H17N3OS/c1-6-10(15-8(3)12-6)7(2)13(4)9(14)5-11/h7H,5,11H2,1-4H3
InChIKeyFLBBCBCVSCQTJO-UHFFFAOYSA-N
MW227.33 g/mol
LogP1.24
Rot. Bonds3

About 2-amino-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-N-methylacetamide

2-amino-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-N-methylacetamide (PubChem CID 119881804) has the molecular formula C10H17N3OS and a molecular weight of 227.33 g/mol. Its IUPAC name is 2-amino-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-N-methylacetamide.

Molecular Properties

Compound Name2-amino-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-N-methylacetamide
PubChem CID119881804
Molecular FormulaC10H17N3OS
Molecular Weight227.33 g/mol
Exact Mass227.11
IUPAC Name2-amino-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-N-methylacetamide
SMILESCc1nc(C)c(C(C)N(C)C(=O)CN)s1
InChIInChI=1S/C10H17N3OS/c1-6-10(15-8(3)12-6)7(2)13(4)9(14)5-11/h7H,5,11H2,1-4H3
InChIKeyFLBBCBCVSCQTJO-UHFFFAOYSA-N
XLogP1.24
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.33
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-N-methylpropanamide;dihydrochloride
CID 119881817
3-amino-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-N-methylbutanamide
CID 119881810
2-amino-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-N-methylpentanamide;dihydrochloride
CID 119881785
N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-3-(4-methoxyphenyl)-N-methylpropanamide
CID 56782362
N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-2-(2-methoxyphenyl)-N-methylacetamide
CID 56782372
4-[3-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl-methylamino]-3-oxopropyl]benzoic acid
CID 119184527
N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-N-methyl-2-quinolin-8-ylacetamide
CID 138038549
4-amino-N-[1-(2-ethyl-4-methyl-1,3-thiazol-5-yl)ethyl]-N-methylbutanamide
CID 119892961
3-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl-methylamino]-3-methylbutanoic acid
CID 110838629
2-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl-methylcarbamoyl]cyclobutane-1-carboxylic acid
CID 120976019
N-[(1S)-1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-N-methyl-2-[[(2S)-oxolan-2-yl]methylamino]acetamide
CID 124693977
3-(3,4-diethoxyphenyl)-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-N-methylprop-2-enamide
CID 72688482

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-N-methylacetamide?
The IUPAC name of 2-amino-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-N-methylacetamide (CID 119881804) is 2-amino-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-N-methylacetamide.
What is the SMILES notation for 2-amino-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-N-methylacetamide?
The canonical SMILES for 2-amino-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-N-methylacetamide is Cc1nc(C)c(C(C)N(C)C(=O)CN)s1.
What is the InChIKey of 2-amino-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-N-methylacetamide?
The InChIKey is FLBBCBCVSCQTJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3OS/c1-6-10(15-8(3)12-6)7(2)13(4)9(14)5-11/h7H,5,11H2,1-4H3.
What are the key properties of 2-amino-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-N-methylacetamide?
2-amino-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-N-methylacetamide has a molecular weight of 227.33 g/mol, XLogP of 1.24, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-N-methylacetamide is sourced from PubChem (CID 119881804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).