2-amino-3-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)propanamide

C9H13N3OS — CID 169194289

IUPAC2-amino-3-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)propanamide
SMILESNC(=O)C(N)CC1CCc2scnc21
InChIInChI=1S/C9H13N3OS/c10-6(9(11)13)3-5-1-2-7-8(5)12-4-14-7/h4-6H,1-3,10H2,(H2,11,13)
InChIKeyTXCAGQQLUZWOPV-UHFFFAOYSA-N
MW211.29 g/mol
LogP0.38
Rot. Bonds3

About 2-amino-3-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)propanamide

2-amino-3-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)propanamide (PubChem CID 169194289) has the molecular formula C9H13N3OS and a molecular weight of 211.29 g/mol. Its IUPAC name is 2-amino-3-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)propanamide.

Molecular Properties

Compound Name2-amino-3-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)propanamide
PubChem CID169194289
Molecular FormulaC9H13N3OS
Molecular Weight211.29 g/mol
Exact Mass211.08
IUPAC Name2-amino-3-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)propanamide
SMILESNC(=O)C(N)CC1CCc2scnc21
InChIInChI=1S/C9H13N3OS/c10-6(9(11)13)3-5-1-2-7-8(5)12-4-14-7/h4-6H,1-3,10H2,(H2,11,13)
InChIKeyTXCAGQQLUZWOPV-UHFFFAOYSA-N
XLogP0.38
TPSA82.00 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.29
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-3-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)propanamide?
The IUPAC name of 2-amino-3-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)propanamide (CID 169194289) is 2-amino-3-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)propanamide.
What is the SMILES notation for 2-amino-3-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)propanamide?
The canonical SMILES for 2-amino-3-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)propanamide is NC(=O)C(N)CC1CCc2scnc21.
What is the InChIKey of 2-amino-3-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)propanamide?
The InChIKey is TXCAGQQLUZWOPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3OS/c10-6(9(11)13)3-5-1-2-7-8(5)12-4-14-7/h4-6H,1-3,10H2,(H2,11,13).
What are the key properties of 2-amino-3-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)propanamide?
2-amino-3-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)propanamide has a molecular weight of 211.29 g/mol, XLogP of 0.38, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)propanamide is sourced from PubChem (CID 169194289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).