2-(Piperazin-1-yl)-N-(1,3-thiazol-2-yl)acetamide--hydrogen chloride (1/2)

C9H16Cl2N4OS — CID 44119132

IUPAC2-piperazin-1-yl-N-(1,3-thiazol-2-yl)acetamide;dihydrochloride
SMILESC1CN(CCN1)CC(=O)NC2=NC=CS2.Cl.Cl
InChIInChI=1S/C9H14N4OS.2ClH/c14-8(12-9-11-3-6-15-9)7-13-4-1-10-2-5-13;;/h3,6,10H,1-2,4-5,7H2,(H,11,12,14);2*1H
InChIKeyQRLHMVLCECKSEI-UHFFFAOYSA-N
MW299.22 g/mol
LogP—
Rot. Bonds3

About 2-(Piperazin-1-yl)-N-(1,3-thiazol-2-yl)acetamide--hydrogen chloride (1/2)

2-(Piperazin-1-yl)-N-(1,3-thiazol-2-yl)acetamide--hydrogen chloride (1/2) (PubChem CID 44119132) has the molecular formula C9H16Cl2N4OS and a molecular weight of 299.22 g/mol. Its IUPAC name is 2-piperazin-1-yl-N-(1,3-thiazol-2-yl)acetamide;dihydrochloride.

Molecular Properties

Compound Name2-(Piperazin-1-yl)-N-(1,3-thiazol-2-yl)acetamide--hydrogen chloride (1/2)
PubChem CID44119132
Molecular FormulaC9H16Cl2N4OS
Molecular Weight299.22 g/mol
Exact Mass298.04
IUPAC Name2-piperazin-1-yl-N-(1,3-thiazol-2-yl)acetamide;dihydrochloride
SMILESC1CN(CCN1)CC(=O)NC2=NC=CS2.Cl.Cl
InChIInChI=1S/C9H14N4OS.2ClH/c14-8(12-9-11-3-6-15-9)7-13-4-1-10-2-5-13;;/h3,6,10H,1-2,4-5,7H2,(H,11,12,14);2*1H
InChIKeyQRLHMVLCECKSEI-UHFFFAOYSA-N
XLogP—
TPSA85.50 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity220

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.22
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-methylpiperidin-1-yl)-N-(1,3-thiazol-2-yl)acetamide
CID 2976467
1-[2-Oxo-2-(1,3-thiazol-2-ylamino)ethyl]piperidine-4-carboxamide
CID 6462725
N-(2-morpholin-4-ylethyl)-N'-(1,3-thiazol-2-yl)oxamide
CID 1948390
2-(4-Acetylamino-piperidin-1-yl)-N-thiazol-2-yl-acetamide
CID 3220976
2-Amino-N-(thiazol-2-yl)acetamide
CID 20558664
2-(Dimethylamino)-N-2-thiazolylacetamide
CID 12562481
N-2-Thiazolyl-4-morpholineacetamide
CID 687268
1-(1,3-Thiazol-2-yl)piperazine--hydrogen chloride (1/2)
CID 21925413
1-(1,3-Thiazol-2-yl)piperazine--hydrogen chloride (1/1)
CID 23467106
1-((2S)-pyrrolidine-2-carbonyl)-4-(1,3-thiazol-2-yl)piperazine dihydrochloride
CID 71756998
4-(Thiazol-2-ylcarbamoylmethyl)-piperazine-1-carboxylic acid ethyl ester
CID 6498214
N-carbamoyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide
CID 29440114

Frequently Asked Questions

What is the IUPAC name of 2-(Piperazin-1-yl)-N-(1,3-thiazol-2-yl)acetamide--hydrogen chloride (1/2)?
The IUPAC name of 2-(Piperazin-1-yl)-N-(1,3-thiazol-2-yl)acetamide--hydrogen chloride (1/2) (CID 44119132) is 2-piperazin-1-yl-N-(1,3-thiazol-2-yl)acetamide;dihydrochloride.
What is the SMILES notation for 2-(Piperazin-1-yl)-N-(1,3-thiazol-2-yl)acetamide--hydrogen chloride (1/2)?
The canonical SMILES for 2-(Piperazin-1-yl)-N-(1,3-thiazol-2-yl)acetamide--hydrogen chloride (1/2) is C1CN(CCN1)CC(=O)NC2=NC=CS2.Cl.Cl.
What is the InChIKey of 2-(Piperazin-1-yl)-N-(1,3-thiazol-2-yl)acetamide--hydrogen chloride (1/2)?
The InChIKey is QRLHMVLCECKSEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4OS.2ClH/c14-8(12-9-11-3-6-15-9)7-13-4-1-10-2-5-13;;/h3,6,10H,1-2,4-5,7H2,(H,11,12,14);2*1H.
What are the key properties of 2-(Piperazin-1-yl)-N-(1,3-thiazol-2-yl)acetamide--hydrogen chloride (1/2)?
2-(Piperazin-1-yl)-N-(1,3-thiazol-2-yl)acetamide--hydrogen chloride (1/2) has a molecular weight of 299.22 g/mol, XLogP of not available, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(Piperazin-1-yl)-N-(1,3-thiazol-2-yl)acetamide--hydrogen chloride (1/2) is sourced from PubChem (CID 44119132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).