N-methyl-2-[2-(methylamino)-1,3-thiazol-4-yl]-N-(2-pyridin-4-ylethyl)acetamide

C14H18N4OS — CID 110386212

IUPACN-methyl-2-[2-(methylamino)-1,3-thiazol-4-yl]-N-(2-pyridin-4-ylethyl)acetamide
SMILESCNc1nc(CC(=O)N(C)CCc2ccncc2)cs1
InChIInChI=1S/C14H18N4OS/c1-15-14-17-12(10-20-14)9-13(19)18(2)8-5-11-3-6-16-7-4-11/h3-4,6-7,10H,5,8-9H2,1-2H3,(H,15,17)
InChIKeyGORWPDZKLITSMK-UHFFFAOYSA-N
MW290.39 g/mol
LogP1.82
Rot. Bonds6

About N-methyl-2-[2-(methylamino)-1,3-thiazol-4-yl]-N-(2-pyridin-4-ylethyl)acetamide

N-methyl-2-[2-(methylamino)-1,3-thiazol-4-yl]-N-(2-pyridin-4-ylethyl)acetamide (PubChem CID 110386212) has the molecular formula C14H18N4OS and a molecular weight of 290.39 g/mol. Its IUPAC name is N-methyl-2-[2-(methylamino)-1,3-thiazol-4-yl]-N-(2-pyridin-4-ylethyl)acetamide.

Molecular Properties

Compound NameN-methyl-2-[2-(methylamino)-1,3-thiazol-4-yl]-N-(2-pyridin-4-ylethyl)acetamide
PubChem CID110386212
Molecular FormulaC14H18N4OS
Molecular Weight290.39 g/mol
Exact Mass290.12
IUPAC NameN-methyl-2-[2-(methylamino)-1,3-thiazol-4-yl]-N-(2-pyridin-4-ylethyl)acetamide
SMILESCNc1nc(CC(=O)N(C)CCc2ccncc2)cs1
InChIInChI=1S/C14H18N4OS/c1-15-14-17-12(10-20-14)9-13(19)18(2)8-5-11-3-6-16-7-4-11/h3-4,6-7,10H,5,8-9H2,1-2H3,(H,15,17)
InChIKeyGORWPDZKLITSMK-UHFFFAOYSA-N
XLogP1.82
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-butyl-N-methyl-2-[2-(methylamino)-1,3-thiazol-4-yl]acetamide
CID 110386244
3-[methyl-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)acetyl]amino]propanoic acid
CID 82032610
N-methyl-2-(methylamino)-N-(2-pyridin-4-ylethyl)acetamide
CID 60913880
2-chloro-N-methyl-N-(2-pyridin-4-ylethyl)acetamide
CID 60913202
2-(4-chlorophenyl)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide
CID 110755605
2-(4-aminophenyl)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide
CID 28711694
N-[4-[2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-oxoethyl]-1,3-thiazol-2-yl]-2-methylpropanamide
CID 55775456
N-[4-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]-1,3-thiazol-2-yl]thiophene-2-carboxamide
CID 134017616
N-methyl-2-(2-methylpropylamino)-N-(2-pyridin-4-ylethyl)acetamide
CID 108993197
N-methyl-3-[methyl(2-pyridin-4-ylethyl)amino]-N-(2-pyridin-4-ylethyl)propanamide
CID 109025999
N-methyl-3-[2-(3-methylphenyl)-1,3-thiazol-4-yl]-N-(2-pyridin-4-ylethyl)propanamide
CID 110333448
2-(2-bromophenyl)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide
CID 56826483

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[2-(methylamino)-1,3-thiazol-4-yl]-N-(2-pyridin-4-ylethyl)acetamide?
The IUPAC name of N-methyl-2-[2-(methylamino)-1,3-thiazol-4-yl]-N-(2-pyridin-4-ylethyl)acetamide (CID 110386212) is N-methyl-2-[2-(methylamino)-1,3-thiazol-4-yl]-N-(2-pyridin-4-ylethyl)acetamide.
What is the SMILES notation for N-methyl-2-[2-(methylamino)-1,3-thiazol-4-yl]-N-(2-pyridin-4-ylethyl)acetamide?
The canonical SMILES for N-methyl-2-[2-(methylamino)-1,3-thiazol-4-yl]-N-(2-pyridin-4-ylethyl)acetamide is CNc1nc(CC(=O)N(C)CCc2ccncc2)cs1.
What is the InChIKey of N-methyl-2-[2-(methylamino)-1,3-thiazol-4-yl]-N-(2-pyridin-4-ylethyl)acetamide?
The InChIKey is GORWPDZKLITSMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4OS/c1-15-14-17-12(10-20-14)9-13(19)18(2)8-5-11-3-6-16-7-4-11/h3-4,6-7,10H,5,8-9H2,1-2H3,(H,15,17).
What are the key properties of N-methyl-2-[2-(methylamino)-1,3-thiazol-4-yl]-N-(2-pyridin-4-ylethyl)acetamide?
N-methyl-2-[2-(methylamino)-1,3-thiazol-4-yl]-N-(2-pyridin-4-ylethyl)acetamide has a molecular weight of 290.39 g/mol, XLogP of 1.82, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[2-(methylamino)-1,3-thiazol-4-yl]-N-(2-pyridin-4-ylethyl)acetamide is sourced from PubChem (CID 110386212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).