N-[2-(dimethylamino)ethyl]-5-methyl-1,3-thiazole-4-carboxamide

C9H15N3OS — CID 110849548

IUPACN-[2-(dimethylamino)ethyl]-5-methyl-1,3-thiazole-4-carboxamide
SMILESCc1scnc1C(=O)NCCN(C)C
InChIInChI=1S/C9H15N3OS/c1-7-8(11-6-14-7)9(13)10-4-5-12(2)3/h6H,4-5H2,1-3H3,(H,10,13)
InChIKeyJEIPKWXETSRBIO-UHFFFAOYSA-N
MW213.31 g/mol
LogP0.74
Rot. Bonds4

About N-[2-(dimethylamino)ethyl]-5-methyl-1,3-thiazole-4-carboxamide

N-[2-(dimethylamino)ethyl]-5-methyl-1,3-thiazole-4-carboxamide (PubChem CID 110849548) has the molecular formula C9H15N3OS and a molecular weight of 213.31 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-5-methyl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-5-methyl-1,3-thiazole-4-carboxamide
PubChem CID110849548
Molecular FormulaC9H15N3OS
Molecular Weight213.31 g/mol
Exact Mass213.09
IUPAC NameN-[2-(dimethylamino)ethyl]-5-methyl-1,3-thiazole-4-carboxamide
SMILESCc1scnc1C(=O)NCCN(C)C
InChIInChI=1S/C9H15N3OS/c1-7-8(11-6-14-7)9(13)10-4-5-12(2)3/h6H,4-5H2,1-3H3,(H,10,13)
InChIKeyJEIPKWXETSRBIO-UHFFFAOYSA-N
XLogP0.74
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.31
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(dimethylamino)ethyl]-1,3-thiazole-4-carboxamide
CID 63038055
N-[2-(dimethylamino)ethyl]-2-methyl-1,3-thiazole-4-carboxamide
CID 110647682
N-[2-(dimethylamino)ethyl]-2-methyl-1,3-oxazole-5-carboxamide
CID 110702158
4-amino-N-[2-(dimethylamino)ethyl]pyridine-2-carboxamide
CID 62154340
N-[2-(dimethylamino)ethyl]-2,3,6-trimethylbenzamide
CID 171383887
N-[2-(dimethylamino)ethyl]-N'-(4-methyl-1,3-thiazol-2-yl)oxamide
CID 44997250
2-(diethylamino)-N-[2-(dimethylamino)ethyl]pyrimidine-5-carboxamide
CID 109252730
N-[2-(dimethylamino)ethyl]-4-methyl-5-propan-2-ylpyrimidine-2-carboxamide
CID 67889944
2-(dimethylamino)ethylcarbamic acid;hydrochloride
CID 118321795
N-[2-(dimethylamino)ethyl]-2-propanoylpyridine-3-carboxamide
CID 143839952
N-[2-(dimethylamino)ethyl]-2-fluoropyridine-4-carboxamide
CID 61294521
2-(dimethylamino)-N-[2-(dimethylamino)ethyl]pyridine-4-carboxamide
CID 84574435

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-5-methyl-1,3-thiazole-4-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-5-methyl-1,3-thiazole-4-carboxamide (CID 110849548) is N-[2-(dimethylamino)ethyl]-5-methyl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-5-methyl-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-5-methyl-1,3-thiazole-4-carboxamide is Cc1scnc1C(=O)NCCN(C)C.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-5-methyl-1,3-thiazole-4-carboxamide?
The InChIKey is JEIPKWXETSRBIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3OS/c1-7-8(11-6-14-7)9(13)10-4-5-12(2)3/h6H,4-5H2,1-3H3,(H,10,13).
What are the key properties of N-[2-(dimethylamino)ethyl]-5-methyl-1,3-thiazole-4-carboxamide?
N-[2-(dimethylamino)ethyl]-5-methyl-1,3-thiazole-4-carboxamide has a molecular weight of 213.31 g/mol, XLogP of 0.74, 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]-5-methyl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 110849548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).