N-cyclopropyl-5-(5-methylfuran-2-yl)-N-[(3-methylthiophen-2-yl)methyl]-1H-pyrazole-3-carboxamide

C18H19N3O2S — CID 70772384

IUPACN-cyclopropyl-5-(5-methylfuran-2-yl)-N-[(3-methylthiophen-2-yl)methyl]-1H-pyrazole-3-carboxamide
SMILESCc1ccc(-c2cc(C(=O)N(Cc3sccc3C)C3CC3)n[nH]2)o1
InChIInChI=1S/C18H19N3O2S/c1-11-7-8-24-17(11)10-21(13-4-5-13)18(22)15-9-14(19-20-15)16-6-3-12(2)23-16/h3,6-9,13H,4-5,10H2,1-2H3,(H,19,20)
InChIKeyDSBRHDHZFDFDDD-UHFFFAOYSA-N
MW341.44 g/mol
LogP4.15
Rot. Bonds5

About N-cyclopropyl-5-(5-methylfuran-2-yl)-N-[(3-methylthiophen-2-yl)methyl]-1H-pyrazole-3-carboxamide

N-cyclopropyl-5-(5-methylfuran-2-yl)-N-[(3-methylthiophen-2-yl)methyl]-1H-pyrazole-3-carboxamide (PubChem CID 70772384) has the molecular formula C18H19N3O2S and a molecular weight of 341.44 g/mol. Its IUPAC name is N-cyclopropyl-5-(5-methylfuran-2-yl)-N-[(3-methylthiophen-2-yl)methyl]-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-(5-methylfuran-2-yl)-N-[(3-methylthiophen-2-yl)methyl]-1H-pyrazole-3-carboxamide
PubChem CID70772384
Molecular FormulaC18H19N3O2S
Molecular Weight341.44 g/mol
Exact Mass341.12
IUPAC NameN-cyclopropyl-5-(5-methylfuran-2-yl)-N-[(3-methylthiophen-2-yl)methyl]-1H-pyrazole-3-carboxamide
SMILESCc1ccc(-c2cc(C(=O)N(Cc3sccc3C)C3CC3)n[nH]2)o1
InChIInChI=1S/C18H19N3O2S/c1-11-7-8-24-17(11)10-21(13-4-5-13)18(22)15-9-14(19-20-15)16-6-3-12(2)23-16/h3,6-9,13H,4-5,10H2,1-2H3,(H,19,20)
InChIKeyDSBRHDHZFDFDDD-UHFFFAOYSA-N
XLogP4.15
TPSA62.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.44
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-cyclopropyl-5-(5-methylfuran-2-yl)-N-[(3-methylthiophen-2-yl)methyl]-1H-pyrazole-3-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-(5-methylfuran-2-yl)-N-[(3-methylthiophen-2-yl)methyl]-1H-pyrazole-3-carboxamide?
The IUPAC name of N-cyclopropyl-5-(5-methylfuran-2-yl)-N-[(3-methylthiophen-2-yl)methyl]-1H-pyrazole-3-carboxamide (CID 70772384) is N-cyclopropyl-5-(5-methylfuran-2-yl)-N-[(3-methylthiophen-2-yl)methyl]-1H-pyrazole-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-(5-methylfuran-2-yl)-N-[(3-methylthiophen-2-yl)methyl]-1H-pyrazole-3-carboxamide?
The canonical SMILES for N-cyclopropyl-5-(5-methylfuran-2-yl)-N-[(3-methylthiophen-2-yl)methyl]-1H-pyrazole-3-carboxamide is Cc1ccc(-c2cc(C(=O)N(Cc3sccc3C)C3CC3)n[nH]2)o1.
What is the InChIKey of N-cyclopropyl-5-(5-methylfuran-2-yl)-N-[(3-methylthiophen-2-yl)methyl]-1H-pyrazole-3-carboxamide?
The InChIKey is DSBRHDHZFDFDDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2S/c1-11-7-8-24-17(11)10-21(13-4-5-13)18(22)15-9-14(19-20-15)16-6-3-12(2)23-16/h3,6-9,13H,4-5,10H2,1-2H3,(H,19,20).
What are the key properties of N-cyclopropyl-5-(5-methylfuran-2-yl)-N-[(3-methylthiophen-2-yl)methyl]-1H-pyrazole-3-carboxamide?
N-cyclopropyl-5-(5-methylfuran-2-yl)-N-[(3-methylthiophen-2-yl)methyl]-1H-pyrazole-3-carboxamide has a molecular weight of 341.44 g/mol, XLogP of 4.15, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-(5-methylfuran-2-yl)-N-[(3-methylthiophen-2-yl)methyl]-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 70772384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).