N-carbamoyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide

C10H15N5O2S — CID 29440114

IUPACN-carbamoyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide
SMILESNC(=O)NC(=O)CN1CCN(c2nccs2)CC1
InChIInChI=1S/C10H15N5O2S/c11-9(17)13-8(16)7-14-2-4-15(5-3-14)10-12-1-6-18-10/h1,6H,2-5,7H2,(H3,11,13,16,17)
InChIKeyBSDYJWDUTITDFX-UHFFFAOYSA-N
MW269.33 g/mol
LogP-0.54
Rot. Bonds3

About N-carbamoyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide

N-carbamoyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide (PubChem CID 29440114) has the molecular formula C10H15N5O2S and a molecular weight of 269.33 g/mol. Its IUPAC name is N-carbamoyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-carbamoyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide
PubChem CID29440114
Molecular FormulaC10H15N5O2S
Molecular Weight269.33 g/mol
Exact Mass269.09
IUPAC NameN-carbamoyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide
SMILESNC(=O)NC(=O)CN1CCN(c2nccs2)CC1
InChIInChI=1S/C10H15N5O2S/c11-9(17)13-8(16)7-14-2-4-15(5-3-14)10-12-1-6-18-10/h1,6H,2-5,7H2,(H3,11,13,16,17)
InChIKeyBSDYJWDUTITDFX-UHFFFAOYSA-N
XLogP-0.54
TPSA91.56 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.33
LogP ≤ 5-0.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide?
The IUPAC name of N-carbamoyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide (CID 29440114) is N-carbamoyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-carbamoyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide?
The canonical SMILES for N-carbamoyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide is NC(=O)NC(=O)CN1CCN(c2nccs2)CC1.
What is the InChIKey of N-carbamoyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide?
The InChIKey is BSDYJWDUTITDFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O2S/c11-9(17)13-8(16)7-14-2-4-15(5-3-14)10-12-1-6-18-10/h1,6H,2-5,7H2,(H3,11,13,16,17).
What are the key properties of N-carbamoyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide?
N-carbamoyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide has a molecular weight of 269.33 g/mol, XLogP of -0.54, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide is sourced from PubChem (CID 29440114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).