4-amino-2-(dimethylamino)-N-[1-(5-methylthiophen-2-yl)propan-2-yl]-1,3-thiazole-5-carboxamide

C14H20N4OS2 — CID 116666930

IUPAC4-amino-2-(dimethylamino)-N-[1-(5-methylthiophen-2-yl)propan-2-yl]-1,3-thiazole-5-carboxamide
SMILESCc1ccc(CC(C)NC(=O)c2sc(N(C)C)nc2N)s1
InChIInChI=1S/C14H20N4OS2/c1-8(7-10-6-5-9(2)20-10)16-13(19)11-12(15)17-14(21-11)18(3)4/h5-6,8H,7,15H2,1-4H3,(H,16,19)
InChIKeyNYMUXBLATPJQIE-UHFFFAOYSA-N
MW324.48 g/mol
LogP2.52
Rot. Bonds5

About 4-amino-2-(dimethylamino)-N-[1-(5-methylthiophen-2-yl)propan-2-yl]-1,3-thiazole-5-carboxamide

4-amino-2-(dimethylamino)-N-[1-(5-methylthiophen-2-yl)propan-2-yl]-1,3-thiazole-5-carboxamide (PubChem CID 116666930) has the molecular formula C14H20N4OS2 and a molecular weight of 324.48 g/mol. Its IUPAC name is 4-amino-2-(dimethylamino)-N-[1-(5-methylthiophen-2-yl)propan-2-yl]-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-2-(dimethylamino)-N-[1-(5-methylthiophen-2-yl)propan-2-yl]-1,3-thiazole-5-carboxamide
PubChem CID116666930
Molecular FormulaC14H20N4OS2
Molecular Weight324.48 g/mol
Exact Mass324.11
IUPAC Name4-amino-2-(dimethylamino)-N-[1-(5-methylthiophen-2-yl)propan-2-yl]-1,3-thiazole-5-carboxamide
SMILESCc1ccc(CC(C)NC(=O)c2sc(N(C)C)nc2N)s1
InChIInChI=1S/C14H20N4OS2/c1-8(7-10-6-5-9(2)20-10)16-13(19)11-12(15)17-14(21-11)18(3)4/h5-6,8H,7,15H2,1-4H3,(H,16,19)
InChIKeyNYMUXBLATPJQIE-UHFFFAOYSA-N
XLogP2.52
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.48
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-amino-2-(dimethylamino)-N-(4-methylhexan-2-yl)-1,3-thiazole-5-carboxamide
CID 116667275
4-amino-N-[1-(5-methylthiophen-2-yl)propan-2-yl]benzamide;hydrochloride
CID 119796726
4-amino-2-(dimethylamino)-N-(1-pyrazol-1-ylpropan-2-yl)-1,3-thiazole-5-carboxamide
CID 116663571
4-amino-2-(dimethylamino)-N-[1-(dimethylamino)-3-methylbutan-2-yl]-1,3-thiazole-5-carboxamide
CID 116663869
4-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)-2-(dimethylamino)-1,3-thiazole-5-carboxamide
CID 106347696
4-amino-2-(dimethylamino)-N-(1-hydroxy-4-methylpentan-3-yl)-1,3-thiazole-5-carboxamide
CID 106358502
4-amino-2-(dimethylamino)-N-(2-methyl-1-thiophen-2-ylpropyl)-1,3-thiazole-5-carboxamide
CID 116664041
4-amino-N-[(5-bromothiophen-2-yl)methyl]-2-(dimethylamino)-1,3-thiazole-5-carboxamide
CID 116666832
2,5,6-trimethyl-N-[(2R)-1-(5-methylthiophen-2-yl)propan-2-yl]-3-oxopyridazine-4-carboxamide
CID 95632509
(2S)-2-amino-N-[1-(5-methylthiophen-2-yl)propan-2-yl]propanamide;hydrochloride
CID 119330928
3-amino-N-[1-(5-methylthiophen-2-yl)propan-2-yl]benzamide;hydrochloride
CID 119796744
methyl N-[1-(5-methylthiophen-2-yl)propan-2-yl]carbamate
CID 115641171

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-(dimethylamino)-N-[1-(5-methylthiophen-2-yl)propan-2-yl]-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-amino-2-(dimethylamino)-N-[1-(5-methylthiophen-2-yl)propan-2-yl]-1,3-thiazole-5-carboxamide (CID 116666930) is 4-amino-2-(dimethylamino)-N-[1-(5-methylthiophen-2-yl)propan-2-yl]-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-amino-2-(dimethylamino)-N-[1-(5-methylthiophen-2-yl)propan-2-yl]-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-amino-2-(dimethylamino)-N-[1-(5-methylthiophen-2-yl)propan-2-yl]-1,3-thiazole-5-carboxamide is Cc1ccc(CC(C)NC(=O)c2sc(N(C)C)nc2N)s1.
What is the InChIKey of 4-amino-2-(dimethylamino)-N-[1-(5-methylthiophen-2-yl)propan-2-yl]-1,3-thiazole-5-carboxamide?
The InChIKey is NYMUXBLATPJQIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4OS2/c1-8(7-10-6-5-9(2)20-10)16-13(19)11-12(15)17-14(21-11)18(3)4/h5-6,8H,7,15H2,1-4H3,(H,16,19).
What are the key properties of 4-amino-2-(dimethylamino)-N-[1-(5-methylthiophen-2-yl)propan-2-yl]-1,3-thiazole-5-carboxamide?
4-amino-2-(dimethylamino)-N-[1-(5-methylthiophen-2-yl)propan-2-yl]-1,3-thiazole-5-carboxamide has a molecular weight of 324.48 g/mol, XLogP of 2.52, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-(dimethylamino)-N-[1-(5-methylthiophen-2-yl)propan-2-yl]-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 116666930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).