4-ethyl-N-[3-(1-methyltetrazol-5-yl)phenyl]-1,3-thiazole-5-carboxamide

C14H14N6OS — CID 136517028

IUPAC4-ethyl-N-[3-(1-methyltetrazol-5-yl)phenyl]-1,3-thiazole-5-carboxamide
SMILESCCc1ncsc1C(=O)Nc1cccc(-c2nnnn2C)c1
InChIInChI=1S/C14H14N6OS/c1-3-11-12(22-8-15-11)14(21)16-10-6-4-5-9(7-10)13-17-18-19-20(13)2/h4-8H,3H2,1-2H3,(H,16,21)
InChIKeyFQQLDAWBBBTXGM-UHFFFAOYSA-N
MW314.37 g/mol
LogP2.15
Rot. Bonds4

About 4-ethyl-N-[3-(1-methyltetrazol-5-yl)phenyl]-1,3-thiazole-5-carboxamide

4-ethyl-N-[3-(1-methyltetrazol-5-yl)phenyl]-1,3-thiazole-5-carboxamide (PubChem CID 136517028) has the molecular formula C14H14N6OS and a molecular weight of 314.37 g/mol. Its IUPAC name is 4-ethyl-N-[3-(1-methyltetrazol-5-yl)phenyl]-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-[3-(1-methyltetrazol-5-yl)phenyl]-1,3-thiazole-5-carboxamide
PubChem CID136517028
Molecular FormulaC14H14N6OS
Molecular Weight314.37 g/mol
Exact Mass314.09
IUPAC Name4-ethyl-N-[3-(1-methyltetrazol-5-yl)phenyl]-1,3-thiazole-5-carboxamide
SMILESCCc1ncsc1C(=O)Nc1cccc(-c2nnnn2C)c1
InChIInChI=1S/C14H14N6OS/c1-3-11-12(22-8-15-11)14(21)16-10-6-4-5-9(7-10)13-17-18-19-20(13)2/h4-8H,3H2,1-2H3,(H,16,21)
InChIKeyFQQLDAWBBBTXGM-UHFFFAOYSA-N
XLogP2.15
TPSA85.59 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.37
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-ethyl-N-[3-(1-methyltetrazol-5-yl)phenyl]-1,3-thiazole-5-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-amino-N-[3-(1-methyltetrazol-5-yl)phenyl]-1,3-thiazole-4-carboxamide
CID 62788208
N-[3-(1-methyltetrazol-5-yl)phenyl]-3-(1,3-thiazol-4-ylmethoxy)benzamide
CID 41360644
N-[3-(1-methyltetrazol-5-yl)phenyl]-2H-triazole-4-carboxamide
CID 112733195
2-bromo-N-[3-(1-methyltetrazol-5-yl)phenyl]benzamide
CID 17422742
3-chloro-N-[3-(1-methyltetrazol-5-yl)phenyl]benzamide
CID 30414116
N-[4-[[3-(1-methyltetrazol-5-yl)phenyl]carbamoylamino]phenyl]propanamide
CID 48783055
3-amino-3-methyl-N-[3-(1-methyltetrazol-5-yl)phenyl]butanamide
CID 64684421
N-[3-(1-methyltetrazol-5-yl)phenyl]but-2-enamide
CID 112723851
5,6-dichloro-N-[3-(1-methyltetrazol-5-yl)phenyl]pyridine-3-carboxamide
CID 51304309
3-amino-N-[3-(1-methyltetrazol-5-yl)phenyl]-1H-1,2,4-triazole-5-carboxamide
CID 62808067
N-[3-(1-methyltetrazol-5-yl)phenyl]-2-thiophen-3-ylacetamide
CID 30414133
(2R)-2-amino-N-[3-(1-methyltetrazol-5-yl)phenyl]propanamide
CID 54991442

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[3-(1-methyltetrazol-5-yl)phenyl]-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-ethyl-N-[3-(1-methyltetrazol-5-yl)phenyl]-1,3-thiazole-5-carboxamide (CID 136517028) is 4-ethyl-N-[3-(1-methyltetrazol-5-yl)phenyl]-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-ethyl-N-[3-(1-methyltetrazol-5-yl)phenyl]-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-ethyl-N-[3-(1-methyltetrazol-5-yl)phenyl]-1,3-thiazole-5-carboxamide is CCc1ncsc1C(=O)Nc1cccc(-c2nnnn2C)c1.
What is the InChIKey of 4-ethyl-N-[3-(1-methyltetrazol-5-yl)phenyl]-1,3-thiazole-5-carboxamide?
The InChIKey is FQQLDAWBBBTXGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N6OS/c1-3-11-12(22-8-15-11)14(21)16-10-6-4-5-9(7-10)13-17-18-19-20(13)2/h4-8H,3H2,1-2H3,(H,16,21).
What are the key properties of 4-ethyl-N-[3-(1-methyltetrazol-5-yl)phenyl]-1,3-thiazole-5-carboxamide?
4-ethyl-N-[3-(1-methyltetrazol-5-yl)phenyl]-1,3-thiazole-5-carboxamide has a molecular weight of 314.37 g/mol, XLogP of 2.15, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[3-(1-methyltetrazol-5-yl)phenyl]-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 136517028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).