N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-1,3-thiazole-4-carboxamide

C14H12Cl2N2OS — CID 63048207

IUPACN-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-1,3-thiazole-4-carboxamide
SMILESO=C(c1cscn1)N(Cc1ccc(Cl)c(Cl)c1)C1CC1
InChIInChI=1S/C14H12Cl2N2OS/c15-11-4-1-9(5-12(11)16)6-18(10-2-3-10)14(19)13-7-20-8-17-13/h1,4-5,7-8,10H,2-3,6H2
InChIKeyFQXSRNYGMWDMAL-UHFFFAOYSA-N
MW327.24 g/mol
LogP4.25
Rot. Bonds4

About N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-1,3-thiazole-4-carboxamide

N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-1,3-thiazole-4-carboxamide (PubChem CID 63048207) has the molecular formula C14H12Cl2N2OS and a molecular weight of 327.24 g/mol. Its IUPAC name is N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-1,3-thiazole-4-carboxamide
PubChem CID63048207
Molecular FormulaC14H12Cl2N2OS
Molecular Weight327.24 g/mol
Exact Mass326.00
IUPAC NameN-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-1,3-thiazole-4-carboxamide
SMILESO=C(c1cscn1)N(Cc1ccc(Cl)c(Cl)c1)C1CC1
InChIInChI=1S/C14H12Cl2N2OS/c15-11-4-1-9(5-12(11)16)6-18(10-2-3-10)14(19)13-7-20-8-17-13/h1,4-5,7-8,10H,2-3,6H2
InChIKeyFQXSRNYGMWDMAL-UHFFFAOYSA-N
XLogP4.25
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.24
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-1,3-thiazole-4-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

N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-1,3-thiazole-4-carboxamide
CID 62045651
5-bromo-N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]thiophene-3-carboxamide
CID 63524947
N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]propanamide
CID 61061495
3-[cyclopropyl(1,3-thiazole-4-carbonyl)amino]propanoic acid
CID 63024405
N-cyclopentyl-N-ethyl-1,3-thiazole-4-carboxamide
CID 63037041
N-cyclobutyl-N-(2-hydroxyethyl)-1,3-thiazole-4-carboxamide
CID 102684545
N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-2-(methylamino)acetamide
CID 54872475
N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-2-methoxyacetamide
CID 61061923
N-cyclobutyl-N-(3-hydroxypropyl)-1,3-thiazole-4-carboxamide
CID 102862752
1-amino-N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]cyclobutane-1-carboxamide
CID 81172021
N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-2-piperidin-4-ylacetamide
CID 119740757
2-(aminomethyl)-N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-3-methylbutanamide
CID 65227497

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-1,3-thiazole-4-carboxamide?
The IUPAC name of N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-1,3-thiazole-4-carboxamide (CID 63048207) is N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-1,3-thiazole-4-carboxamide is O=C(c1cscn1)N(Cc1ccc(Cl)c(Cl)c1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-1,3-thiazole-4-carboxamide?
The InChIKey is FQXSRNYGMWDMAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2OS/c15-11-4-1-9(5-12(11)16)6-18(10-2-3-10)14(19)13-7-20-8-17-13/h1,4-5,7-8,10H,2-3,6H2.
What are the key properties of N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-1,3-thiazole-4-carboxamide?
N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-1,3-thiazole-4-carboxamide has a molecular weight of 327.24 g/mol, XLogP of 4.25, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 63048207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).