N-[2-[ethyl(methyl)amino]ethyl]-1,3-thiazolidine-4-carboxamide

C9H19N3OS — CID 62640959

IUPACN-[2-[ethyl(methyl)amino]ethyl]-1,3-thiazolidine-4-carboxamide
SMILESCCN(C)CCNC(=O)C1CSCN1
InChIInChI=1S/C9H19N3OS/c1-3-12(2)5-4-10-9(13)8-6-14-7-11-8/h8,11H,3-7H2,1-2H3,(H,10,13)
InChIKeyCVVODDXKMDOYIY-UHFFFAOYSA-N
MW217.34 g/mol
LogP-0.28
Rot. Bonds5

About N-[2-[ethyl(methyl)amino]ethyl]-1,3-thiazolidine-4-carboxamide

N-[2-[ethyl(methyl)amino]ethyl]-1,3-thiazolidine-4-carboxamide (PubChem CID 62640959) has the molecular formula C9H19N3OS and a molecular weight of 217.34 g/mol. Its IUPAC name is N-[2-[ethyl(methyl)amino]ethyl]-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-[2-[ethyl(methyl)amino]ethyl]-1,3-thiazolidine-4-carboxamide
PubChem CID62640959
Molecular FormulaC9H19N3OS
Molecular Weight217.34 g/mol
Exact Mass217.12
IUPAC NameN-[2-[ethyl(methyl)amino]ethyl]-1,3-thiazolidine-4-carboxamide
SMILESCCN(C)CCNC(=O)C1CSCN1
InChIInChI=1S/C9H19N3OS/c1-3-12(2)5-4-10-9(13)8-6-14-7-11-8/h8,11H,3-7H2,1-2H3,(H,10,13)
InChIKeyCVVODDXKMDOYIY-UHFFFAOYSA-N
XLogP-0.28
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.34
LogP ≤ 5-0.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(diethylamino)ethyl]-1,3-thiazolidine-4-carboxamide
CID 24692990
N-[2-[cyclopentyl(methyl)amino]ethyl]-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 119878784
(4S)-N-[3-(dimethylamino)-3-oxopropyl]-1,3-thiazolidine-4-carboxamide
CID 93356367
(2S)-N-[2-[ethyl(methyl)amino]ethyl]pyrrolidine-2-carboxamide
CID 62641676
N-[3-(dimethylamino)-3-oxopropyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119293605
(2R)-N-[2-[ethyl(methyl)amino]ethyl]piperidine-2-carboxamide;dihydrochloride
CID 119866061
(4S)-N-(2-acetamidoethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119268318
N-(2-bromoethyl)-1,3-thiazolidine-4-carboxamide
CID 154729350
N-(2-ethoxyethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119280656
N-[2-[ethyl(methyl)amino]ethyl]-5-methylpiperazine-2-carboxamide
CID 63102583
N-(2-methylsulfinylethyl)-1,3-thiazolidine-4-carboxamide
CID 115734124
N-(3-amino-3-oxopropyl)-1,3-thiazolidine-4-carboxamide
CID 43553640

Frequently Asked Questions

What is the IUPAC name of N-[2-[ethyl(methyl)amino]ethyl]-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-[2-[ethyl(methyl)amino]ethyl]-1,3-thiazolidine-4-carboxamide (CID 62640959) is N-[2-[ethyl(methyl)amino]ethyl]-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-[2-[ethyl(methyl)amino]ethyl]-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-[2-[ethyl(methyl)amino]ethyl]-1,3-thiazolidine-4-carboxamide is CCN(C)CCNC(=O)C1CSCN1.
What is the InChIKey of N-[2-[ethyl(methyl)amino]ethyl]-1,3-thiazolidine-4-carboxamide?
The InChIKey is CVVODDXKMDOYIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3OS/c1-3-12(2)5-4-10-9(13)8-6-14-7-11-8/h8,11H,3-7H2,1-2H3,(H,10,13).
What are the key properties of N-[2-[ethyl(methyl)amino]ethyl]-1,3-thiazolidine-4-carboxamide?
N-[2-[ethyl(methyl)amino]ethyl]-1,3-thiazolidine-4-carboxamide has a molecular weight of 217.34 g/mol, XLogP of -0.28, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[ethyl(methyl)amino]ethyl]-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 62640959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).