2-(methylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]acetamide;dihydrochloride

C10H19Cl2N3OS — CID 119858736

IUPAC2-(methylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]acetamide;dihydrochloride
SMILESCNCC(=O)NC(C)(C)c1nc(C)cs1.Cl.Cl
InChIInChI=1S/C10H17N3OS.2ClH/c1-7-6-15-9(12-7)10(2,3)13-8(14)5-11-4;;/h6,11H,5H2,1-4H3,(H,13,14);2*1H
InChIKeyGDBLBILBDFPCQP-UHFFFAOYSA-N
MW300.26 g/mol
LogP1.87
Rot. Bonds4

About 2-(methylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]acetamide;dihydrochloride

2-(methylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]acetamide;dihydrochloride (PubChem CID 119858736) has the molecular formula C10H19Cl2N3OS and a molecular weight of 300.26 g/mol. Its IUPAC name is 2-(methylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]acetamide;dihydrochloride.

Molecular Properties

Compound Name2-(methylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]acetamide;dihydrochloride
PubChem CID119858736
Molecular FormulaC10H19Cl2N3OS
Molecular Weight300.26 g/mol
Exact Mass299.06
IUPAC Name2-(methylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]acetamide;dihydrochloride
SMILESCNCC(=O)NC(C)(C)c1nc(C)cs1.Cl.Cl
InChIInChI=1S/C10H17N3OS.2ClH/c1-7-6-15-9(12-7)10(2,3)13-8(14)5-11-4;;/h6,11H,5H2,1-4H3,(H,13,14);2*1H
InChIKeyGDBLBILBDFPCQP-UHFFFAOYSA-N
XLogP1.87
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.26
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]propanamide
CID 110470336
2-(1-hydroxycyclohexyl)-N-[2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]acetamide
CID 111520518
4-(aminomethyl)-N-[2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]benzamide;dihydrochloride
CID 119858740
2-amino-N-[2-(4-methyl-1,3-thiazol-2-yl)butan-2-yl]acetamide;dihydrochloride
CID 119892019
2-(methylamino)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]acetamide
CID 61043728
5-amino-2-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]benzamide;dihydrochloride
CID 120644605
2-amino-N-[2-(4-methyl-1,3-thiazol-2-yl)butan-2-yl]acetamide
CID 119892020
2-methyl-3-(methylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)butan-2-yl]propanamide
CID 119892016
3-fluoro-N-[2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]benzamide
CID 110472495
2-(4-methyl-1,3-thiazol-2-yl)propan-2-amine;hydrochloride
CID 52988778
(2S,4S)-2-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]piperidine-4-carboxamide
CID 120644604
methyl 2-[2-(4-methyl-1,3-thiazol-2-yl)butan-2-ylamino]acetate
CID 71986453

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]acetamide;dihydrochloride?
The IUPAC name of 2-(methylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]acetamide;dihydrochloride (CID 119858736) is 2-(methylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]acetamide;dihydrochloride.
What is the SMILES notation for 2-(methylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]acetamide;dihydrochloride?
The canonical SMILES for 2-(methylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]acetamide;dihydrochloride is CNCC(=O)NC(C)(C)c1nc(C)cs1.Cl.Cl.
What is the InChIKey of 2-(methylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]acetamide;dihydrochloride?
The InChIKey is GDBLBILBDFPCQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3OS.2ClH/c1-7-6-15-9(12-7)10(2,3)13-8(14)5-11-4;;/h6,11H,5H2,1-4H3,(H,13,14);2*1H.
What are the key properties of 2-(methylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]acetamide;dihydrochloride?
2-(methylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]acetamide;dihydrochloride has a molecular weight of 300.26 g/mol, XLogP of 1.87, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]acetamide;dihydrochloride is sourced from PubChem (CID 119858736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).