2-ethyl-N,4,5-trimethyl-N-[(5-methylfuran-2-yl)methyl]thieno[2,3-d]pyrimidine-6-carboxamide

C18H21N3O2S — CID 43044769

IUPAC2-ethyl-N,4,5-trimethyl-N-[(5-methylfuran-2-yl)methyl]thieno[2,3-d]pyrimidine-6-carboxamide
SMILESCCc1nc(C)c2c(C)c(C(=O)N(C)Cc3ccc(C)o3)sc2n1
InChIInChI=1S/C18H21N3O2S/c1-6-14-19-12(4)15-11(3)16(24-17(15)20-14)18(22)21(5)9-13-8-7-10(2)23-13/h7-8H,6,9H2,1-5H3
InChIKeyJFEVADJVFAMSHV-UHFFFAOYSA-N
MW343.45 g/mol
LogP4.04
Rot. Bonds4

About 2-ethyl-N,4,5-trimethyl-N-[(5-methylfuran-2-yl)methyl]thieno[2,3-d]pyrimidine-6-carboxamide

2-ethyl-N,4,5-trimethyl-N-[(5-methylfuran-2-yl)methyl]thieno[2,3-d]pyrimidine-6-carboxamide (PubChem CID 43044769) has the molecular formula C18H21N3O2S and a molecular weight of 343.45 g/mol. Its IUPAC name is 2-ethyl-N,4,5-trimethyl-N-[(5-methylfuran-2-yl)methyl]thieno[2,3-d]pyrimidine-6-carboxamide.

Molecular Properties

Compound Name2-ethyl-N,4,5-trimethyl-N-[(5-methylfuran-2-yl)methyl]thieno[2,3-d]pyrimidine-6-carboxamide
PubChem CID43044769
Molecular FormulaC18H21N3O2S
Molecular Weight343.45 g/mol
Exact Mass343.14
IUPAC Name2-ethyl-N,4,5-trimethyl-N-[(5-methylfuran-2-yl)methyl]thieno[2,3-d]pyrimidine-6-carboxamide
SMILESCCc1nc(C)c2c(C)c(C(=O)N(C)Cc3ccc(C)o3)sc2n1
InChIInChI=1S/C18H21N3O2S/c1-6-14-19-12(4)15-11(3)16(24-17(15)20-14)18(22)21(5)9-13-8-7-10(2)23-13/h7-8H,6,9H2,1-5H3
InChIKeyJFEVADJVFAMSHV-UHFFFAOYSA-N
XLogP4.04
TPSA59.23 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.45
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-ethyl-N,4,5-trimethyl-N-[(5-methylfuran-2-yl)methyl]thieno[2,3-d]pyrimidine-6-carboxamide 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

2-ethyl-N-[(2-fluorophenyl)methyl]-N,4,5-trimethylthieno[2,3-d]pyrimidine-6-carboxamide
CID 38046916
N,3,5-trimethyl-N-[(5-methylfuran-2-yl)methyl]-4-oxothieno[2,3-d]pyrimidine-6-carboxamide
CID 31151904
5-[[(2-ethyl-4,5-dimethylthieno[2,3-d]pyrimidine-6-carbonyl)amino]methyl]furan-2-carboxylic acid
CID 75429505
2-(4-ethoxyphenyl)-N,4-dimethyl-N-[(5-methylfuran-2-yl)methyl]-1,3-thiazole-5-carboxamide
CID 55605803
2-ethyl-N-[(2R)-1-methoxypropan-2-yl]-N,4,5-trimethylthieno[2,3-d]pyrimidine-6-carboxamide
CID 94173419
2-N,5-N-dimethyl-2-N,5-N-bis[(5-methylfuran-2-yl)methyl]thiophene-2,5-dicarboxamide
CID 56809035
N-ethyl-N,2,4,5-tetramethylthieno[2,3-d]pyrimidine-6-carboxamide
CID 134063367
N-[6-(dimethylamino)-3-pyridinyl]-2-ethyl-4,5-dimethylthieno[2,3-d]pyrimidine-6-carboxamide
CID 18157752
N-(1,3-benzodioxol-5-ylmethyl)-2-ethyl-4,5-dimethylthieno[2,3-d]pyrimidine-6-carboxamide
CID 33394339
N,6-dimethyl-N-[(5-methylfuran-2-yl)methyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide
CID 56752079
N-benzyl-2-cyclopropyl-N,4,5-trimethylthieno[2,3-d]pyrimidine-6-carboxamide
CID 24662376
2-ethyl-4,5-dimethyl-N-(pyridin-2-ylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide
CID 25331738

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N,4,5-trimethyl-N-[(5-methylfuran-2-yl)methyl]thieno[2,3-d]pyrimidine-6-carboxamide?
The IUPAC name of 2-ethyl-N,4,5-trimethyl-N-[(5-methylfuran-2-yl)methyl]thieno[2,3-d]pyrimidine-6-carboxamide (CID 43044769) is 2-ethyl-N,4,5-trimethyl-N-[(5-methylfuran-2-yl)methyl]thieno[2,3-d]pyrimidine-6-carboxamide.
What is the SMILES notation for 2-ethyl-N,4,5-trimethyl-N-[(5-methylfuran-2-yl)methyl]thieno[2,3-d]pyrimidine-6-carboxamide?
The canonical SMILES for 2-ethyl-N,4,5-trimethyl-N-[(5-methylfuran-2-yl)methyl]thieno[2,3-d]pyrimidine-6-carboxamide is CCc1nc(C)c2c(C)c(C(=O)N(C)Cc3ccc(C)o3)sc2n1.
What is the InChIKey of 2-ethyl-N,4,5-trimethyl-N-[(5-methylfuran-2-yl)methyl]thieno[2,3-d]pyrimidine-6-carboxamide?
The InChIKey is JFEVADJVFAMSHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O2S/c1-6-14-19-12(4)15-11(3)16(24-17(15)20-14)18(22)21(5)9-13-8-7-10(2)23-13/h7-8H,6,9H2,1-5H3.
What are the key properties of 2-ethyl-N,4,5-trimethyl-N-[(5-methylfuran-2-yl)methyl]thieno[2,3-d]pyrimidine-6-carboxamide?
2-ethyl-N,4,5-trimethyl-N-[(5-methylfuran-2-yl)methyl]thieno[2,3-d]pyrimidine-6-carboxamide has a molecular weight of 343.45 g/mol, XLogP of 4.04, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N,4,5-trimethyl-N-[(5-methylfuran-2-yl)methyl]thieno[2,3-d]pyrimidine-6-carboxamide is sourced from PubChem (CID 43044769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).