N-[2-(dimethylamino)ethyl]-1,3-thiazole-4-carboxamide

C8H13N3OS — CID 63038055

IUPACN-[2-(dimethylamino)ethyl]-1,3-thiazole-4-carboxamide
SMILESCN(C)CCNC(=O)c1cscn1
InChIInChI=1S/C8H13N3OS/c1-11(2)4-3-9-8(12)7-5-13-6-10-7/h5-6H,3-4H2,1-2H3,(H,9,12)
InChIKeyXYJSCDGTSDQRID-UHFFFAOYSA-N
MW199.28 g/mol
LogP0.43
Rot. Bonds4

About N-[2-(dimethylamino)ethyl]-1,3-thiazole-4-carboxamide

N-[2-(dimethylamino)ethyl]-1,3-thiazole-4-carboxamide (PubChem CID 63038055) has the molecular formula C8H13N3OS and a molecular weight of 199.28 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-1,3-thiazole-4-carboxamide
PubChem CID63038055
Molecular FormulaC8H13N3OS
Molecular Weight199.28 g/mol
Exact Mass199.08
IUPAC NameN-[2-(dimethylamino)ethyl]-1,3-thiazole-4-carboxamide
SMILESCN(C)CCNC(=O)c1cscn1
InChIInChI=1S/C8H13N3OS/c1-11(2)4-3-9-8(12)7-5-13-6-10-7/h5-6H,3-4H2,1-2H3,(H,9,12)
InChIKeyXYJSCDGTSDQRID-UHFFFAOYSA-N
XLogP0.43
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.28
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[ethyl(propyl)amino]ethyl]-1,3-thiazole-4-carboxamide
CID 103719294
N-pentyl-1,3-thiazole-4-carboxamide
CID 62045475
N-butyl-1,3-thiazole-4-carboxamide;ethane
CID 176555037
N-(3-acetamidopropyl)-1,3-thiazole-4-carboxamide
CID 84557796
N-prop-2-enyl-1,3-thiazole-4-carboxamide
CID 63038406
N-[2-(dimethylamino)ethyl]-2-methyl-1,3-thiazole-4-carboxamide
CID 110647682
N-(3-amino-3-hydroxyiminopropyl)-1,3-thiazole-4-carboxamide
CID 76982242
2-(1,3-thiazole-4-carbonylamino)ethyl carbamate
CID 83205186
N'-ethyl-N'-methyl-1,3-thiazole-4-carbohydrazide
CID 130734598
11-(1,3-thiazole-4-carbonylamino)undecanoic acid
CID 84556786
N-[3-(2-methoxyethylamino)-3-oxopropyl]-1,3-thiazole-4-carboxamide
CID 112689477
N-[2-(dimethylamino)ethyl]-5-methyl-1,3-thiazole-4-carboxamide
CID 110849548

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-1,3-thiazole-4-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-1,3-thiazole-4-carboxamide (CID 63038055) is N-[2-(dimethylamino)ethyl]-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-1,3-thiazole-4-carboxamide is CN(C)CCNC(=O)c1cscn1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-1,3-thiazole-4-carboxamide?
The InChIKey is XYJSCDGTSDQRID-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3OS/c1-11(2)4-3-9-8(12)7-5-13-6-10-7/h5-6H,3-4H2,1-2H3,(H,9,12).
What are the key properties of N-[2-(dimethylamino)ethyl]-1,3-thiazole-4-carboxamide?
N-[2-(dimethylamino)ethyl]-1,3-thiazole-4-carboxamide has a molecular weight of 199.28 g/mol, XLogP of 0.43, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 63038055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).