2-[6-(ethylcarbamoylamino)-3-pyridinyl]-4-N,4-N-dimethyl-5-N-propan-2-yl-1,3-thiazole-4,5-dicarboxamide

C18H24N6O3S — CID 59208344

IUPAC2-[6-(ethylcarbamoylamino)-3-pyridinyl]-4-N,4-N-dimethyl-5-N-propan-2-yl-1,3-thiazole-4,5-dicarboxamide
SMILESCCNC(=O)Nc1ccc(-c2nc(C(=O)N(C)C)c(C(=O)NC(C)C)s2)cn1
InChIInChI=1S/C18H24N6O3S/c1-6-19-18(27)22-12-8-7-11(9-20-12)16-23-13(17(26)24(4)5)14(28-16)15(25)21-10(2)3/h7-10H,6H2,1-5H3,(H,21,25)(H2,19,20,22,27)
InChIKeyNZIYHYHARQIWJC-UHFFFAOYSA-N
MW404.50 g/mol
LogP2.19
Rot. Bonds6

About 2-[6-(ethylcarbamoylamino)-3-pyridinyl]-4-N,4-N-dimethyl-5-N-propan-2-yl-1,3-thiazole-4,5-dicarboxamide

2-[6-(ethylcarbamoylamino)-3-pyridinyl]-4-N,4-N-dimethyl-5-N-propan-2-yl-1,3-thiazole-4,5-dicarboxamide (PubChem CID 59208344) has the molecular formula C18H24N6O3S and a molecular weight of 404.50 g/mol. Its IUPAC name is 2-[6-(ethylcarbamoylamino)-3-pyridinyl]-4-N,4-N-dimethyl-5-N-propan-2-yl-1,3-thiazole-4,5-dicarboxamide.

Molecular Properties

Compound Name2-[6-(ethylcarbamoylamino)-3-pyridinyl]-4-N,4-N-dimethyl-5-N-propan-2-yl-1,3-thiazole-4,5-dicarboxamide
PubChem CID59208344
Molecular FormulaC18H24N6O3S
Molecular Weight404.50 g/mol
Exact Mass404.16
IUPAC Name2-[6-(ethylcarbamoylamino)-3-pyridinyl]-4-N,4-N-dimethyl-5-N-propan-2-yl-1,3-thiazole-4,5-dicarboxamide
SMILESCCNC(=O)Nc1ccc(-c2nc(C(=O)N(C)C)c(C(=O)NC(C)C)s2)cn1
InChIInChI=1S/C18H24N6O3S/c1-6-19-18(27)22-12-8-7-11(9-20-12)16-23-13(17(26)24(4)5)14(28-16)15(25)21-10(2)3/h7-10H,6H2,1-5H3,(H,21,25)(H2,19,20,22,27)
InChIKeyNZIYHYHARQIWJC-UHFFFAOYSA-N
XLogP2.19
TPSA116.32 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.50
LogP ≤ 52.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 2-[6-(ethylcarbamoylamino)-3-pyridinyl]-4-N,4-N-dimethyl-5-N-propan-2-yl-1,3-thiazole-4,5-dicarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-N-tert-butyl-2-[6-(ethylcarbamoylamino)-3-pyridinyl]-4-N,4-N-dimethyl-1,3-thiazole-4,5-dicarboxamide
CID 59208409
2-[6-(ethylcarbamoylamino)-3-pyridinyl]-N-methoxy-1,3-thiazole-5-carboxamide
CID 59208396
1-ethyl-3-(5-pyridin-3-yl-2-pyridinyl)urea
CID 72712074
4-[6-(ethylcarbamoylamino)-3-pyridinyl]-N-(4-methoxy-2-pyridinyl)-N-methylthieno[2,3-c]pyridine-2-carboxamide
CID 177337182
4-[6-(ethylcarbamoylamino)-3-pyridinyl]-N-(6-methoxy-2-pyridinyl)-N-methylthieno[2,3-c]pyridine-2-carboxamide
CID 177337170
ethyl 4-(butylcarbamoyl)-2-[6-(ethylcarbamoylamino)-4-phenyl-3-pyridinyl]-1,3-thiazole-5-carboxylate
CID 59208375
1-[5-(diethylamino)-2-pyridinyl]-3-propan-2-ylurea
CID 113029739
N-[5-(1,3-thiazol-2-yl)-2-pyridinyl]propanamide
CID 123161282
1-ethyl-3-[6-[6-(ethylamino)-3-pyridinyl]-[1,3]thiazolo[5,4-b]pyridin-2-yl]urea
CID 89172913
4-methyl-N-propan-2-yl-2-(2-propyl-4-pyridinyl)-1,3-thiazole-5-carboxamide
CID 53367712
1-[5-(N-methylanilino)-2-pyridinyl]-3-propan-2-ylurea
CID 113031703
[4-[6-(ethylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]phenyl] N,N-dimethylcarbamate
CID 16727156

Frequently Asked Questions

What is the IUPAC name of 2-[6-(ethylcarbamoylamino)-3-pyridinyl]-4-N,4-N-dimethyl-5-N-propan-2-yl-1,3-thiazole-4,5-dicarboxamide?
The IUPAC name of 2-[6-(ethylcarbamoylamino)-3-pyridinyl]-4-N,4-N-dimethyl-5-N-propan-2-yl-1,3-thiazole-4,5-dicarboxamide (CID 59208344) is 2-[6-(ethylcarbamoylamino)-3-pyridinyl]-4-N,4-N-dimethyl-5-N-propan-2-yl-1,3-thiazole-4,5-dicarboxamide.
What is the SMILES notation for 2-[6-(ethylcarbamoylamino)-3-pyridinyl]-4-N,4-N-dimethyl-5-N-propan-2-yl-1,3-thiazole-4,5-dicarboxamide?
The canonical SMILES for 2-[6-(ethylcarbamoylamino)-3-pyridinyl]-4-N,4-N-dimethyl-5-N-propan-2-yl-1,3-thiazole-4,5-dicarboxamide is CCNC(=O)Nc1ccc(-c2nc(C(=O)N(C)C)c(C(=O)NC(C)C)s2)cn1.
What is the InChIKey of 2-[6-(ethylcarbamoylamino)-3-pyridinyl]-4-N,4-N-dimethyl-5-N-propan-2-yl-1,3-thiazole-4,5-dicarboxamide?
The InChIKey is NZIYHYHARQIWJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N6O3S/c1-6-19-18(27)22-12-8-7-11(9-20-12)16-23-13(17(26)24(4)5)14(28-16)15(25)21-10(2)3/h7-10H,6H2,1-5H3,(H,21,25)(H2,19,20,22,27).
What are the key properties of 2-[6-(ethylcarbamoylamino)-3-pyridinyl]-4-N,4-N-dimethyl-5-N-propan-2-yl-1,3-thiazole-4,5-dicarboxamide?
2-[6-(ethylcarbamoylamino)-3-pyridinyl]-4-N,4-N-dimethyl-5-N-propan-2-yl-1,3-thiazole-4,5-dicarboxamide has a molecular weight of 404.50 g/mol, XLogP of 2.19, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(ethylcarbamoylamino)-3-pyridinyl]-4-N,4-N-dimethyl-5-N-propan-2-yl-1,3-thiazole-4,5-dicarboxamide is sourced from PubChem (CID 59208344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).