N-(2-aminoethyl)-1,3-thiazolidine-4-carboxamide

C6H13N3OS — CID 61275102

IUPACN-(2-aminoethyl)-1,3-thiazolidine-4-carboxamide
SMILESNCCNC(=O)C1CSCN1
InChIInChI=1S/C6H13N3OS/c7-1-2-8-6(10)5-3-11-4-9-5/h5,9H,1-4,7H2,(H,8,10)
InChIKeyLVNQIWLXMGNICD-UHFFFAOYSA-N
MW175.26 g/mol
LogP-1.28
Rot. Bonds3

About N-(2-aminoethyl)-1,3-thiazolidine-4-carboxamide

N-(2-aminoethyl)-1,3-thiazolidine-4-carboxamide (PubChem CID 61275102) has the molecular formula C6H13N3OS and a molecular weight of 175.26 g/mol. Its IUPAC name is N-(2-aminoethyl)-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-1,3-thiazolidine-4-carboxamide
PubChem CID61275102
Molecular FormulaC6H13N3OS
Molecular Weight175.26 g/mol
Exact Mass175.08
IUPAC NameN-(2-aminoethyl)-1,3-thiazolidine-4-carboxamide
SMILESNCCNC(=O)C1CSCN1
InChIInChI=1S/C6H13N3OS/c7-1-2-8-6(10)5-3-11-4-9-5/h5,9H,1-4,7H2,(H,8,10)
InChIKeyLVNQIWLXMGNICD-UHFFFAOYSA-N
XLogP-1.28
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.26
LogP ≤ 5-1.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-(2-aminoethyl)-1,3-thiazolidine-4-carboxamide (CID 61275102) is N-(2-aminoethyl)-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-(2-aminoethyl)-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-(2-aminoethyl)-1,3-thiazolidine-4-carboxamide is NCCNC(=O)C1CSCN1.
What is the InChIKey of N-(2-aminoethyl)-1,3-thiazolidine-4-carboxamide?
The InChIKey is LVNQIWLXMGNICD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3OS/c7-1-2-8-6(10)5-3-11-4-9-5/h5,9H,1-4,7H2,(H,8,10).
What are the key properties of N-(2-aminoethyl)-1,3-thiazolidine-4-carboxamide?
N-(2-aminoethyl)-1,3-thiazolidine-4-carboxamide has a molecular weight of 175.26 g/mol, XLogP of -1.28, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 61275102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).