N,N-dipropyl-1,2-thiazole-5-carboxamide

C10H16N2OS — CID 110692163

IUPACN,N-dipropyl-1,2-thiazole-5-carboxamide
SMILESCCCN(CCC)C(=O)c1ccns1
InChIInChI=1S/C10H16N2OS/c1-3-7-12(8-4-2)10(13)9-5-6-11-14-9/h5-6H,3-4,7-8H2,1-2H3
InChIKeyBCFTUVFIHBMAFV-UHFFFAOYSA-N
MW212.32 g/mol
LogP2.41
Rot. Bonds5

About N,N-dipropyl-1,2-thiazole-5-carboxamide

N,N-dipropyl-1,2-thiazole-5-carboxamide (PubChem CID 110692163) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is N,N-dipropyl-1,2-thiazole-5-carboxamide.

Molecular Properties

Compound NameN,N-dipropyl-1,2-thiazole-5-carboxamide
PubChem CID110692163
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC NameN,N-dipropyl-1,2-thiazole-5-carboxamide
SMILESCCCN(CCC)C(=O)c1ccns1
InChIInChI=1S/C10H16N2OS/c1-3-7-12(8-4-2)10(13)9-5-6-11-14-9/h5-6H,3-4,7-8H2,1-2H3
InChIKeyBCFTUVFIHBMAFV-UHFFFAOYSA-N
XLogP2.41
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dipropyl-1,2-thiazole-5-carboxamide?
The IUPAC name of N,N-dipropyl-1,2-thiazole-5-carboxamide (CID 110692163) is N,N-dipropyl-1,2-thiazole-5-carboxamide.
What is the SMILES notation for N,N-dipropyl-1,2-thiazole-5-carboxamide?
The canonical SMILES for N,N-dipropyl-1,2-thiazole-5-carboxamide is CCCN(CCC)C(=O)c1ccns1.
What is the InChIKey of N,N-dipropyl-1,2-thiazole-5-carboxamide?
The InChIKey is BCFTUVFIHBMAFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-3-7-12(8-4-2)10(13)9-5-6-11-14-9/h5-6H,3-4,7-8H2,1-2H3.
What are the key properties of N,N-dipropyl-1,2-thiazole-5-carboxamide?
N,N-dipropyl-1,2-thiazole-5-carboxamide has a molecular weight of 212.32 g/mol, XLogP of 2.41, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dipropyl-1,2-thiazole-5-carboxamide is sourced from PubChem (CID 110692163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).