N,5-dimethyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]-N-(2-methylpropyl)pyrazole-4-carboxamide

C19H23N5O2 — CID 26349683

IUPACN,5-dimethyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]-N-(2-methylpropyl)pyrazole-4-carboxamide
SMILESCc1ccc(-c2ccnc(-n3ncc(C(=O)N(C)CC(C)C)c3C)n2)o1
InChIInChI=1S/C19H23N5O2/c1-12(2)11-23(5)18(25)15-10-21-24(14(15)4)19-20-9-8-16(22-19)17-7-6-13(3)26-17/h6-10,12H,11H2,1-5H3
InChIKeyLDFJCDOQKSUOTR-UHFFFAOYSA-N
MW353.43 g/mol
LogP3.27
Rot. Bonds5

About N,5-dimethyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]-N-(2-methylpropyl)pyrazole-4-carboxamide

N,5-dimethyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]-N-(2-methylpropyl)pyrazole-4-carboxamide (PubChem CID 26349683) has the molecular formula C19H23N5O2 and a molecular weight of 353.43 g/mol. Its IUPAC name is N,5-dimethyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]-N-(2-methylpropyl)pyrazole-4-carboxamide.

Molecular Properties

Compound NameN,5-dimethyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]-N-(2-methylpropyl)pyrazole-4-carboxamide
PubChem CID26349683
Molecular FormulaC19H23N5O2
Molecular Weight353.43 g/mol
Exact Mass353.19
IUPAC NameN,5-dimethyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]-N-(2-methylpropyl)pyrazole-4-carboxamide
SMILESCc1ccc(-c2ccnc(-n3ncc(C(=O)N(C)CC(C)C)c3C)n2)o1
InChIInChI=1S/C19H23N5O2/c1-12(2)11-23(5)18(25)15-10-21-24(14(15)4)19-20-9-8-16(22-19)17-7-6-13(3)26-17/h6-10,12H,11H2,1-5H3
InChIKeyLDFJCDOQKSUOTR-UHFFFAOYSA-N
XLogP3.27
TPSA77.05 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N,5-dimethyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]-N-(2-methylpropyl)pyrazole-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

Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]-N-(2-methylpropyl)pyrazole-4-carboxamide?
The IUPAC name of N,5-dimethyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]-N-(2-methylpropyl)pyrazole-4-carboxamide (CID 26349683) is N,5-dimethyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]-N-(2-methylpropyl)pyrazole-4-carboxamide.
What is the SMILES notation for N,5-dimethyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]-N-(2-methylpropyl)pyrazole-4-carboxamide?
The canonical SMILES for N,5-dimethyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]-N-(2-methylpropyl)pyrazole-4-carboxamide is Cc1ccc(-c2ccnc(-n3ncc(C(=O)N(C)CC(C)C)c3C)n2)o1.
What is the InChIKey of N,5-dimethyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]-N-(2-methylpropyl)pyrazole-4-carboxamide?
The InChIKey is LDFJCDOQKSUOTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O2/c1-12(2)11-23(5)18(25)15-10-21-24(14(15)4)19-20-9-8-16(22-19)17-7-6-13(3)26-17/h6-10,12H,11H2,1-5H3.
What are the key properties of N,5-dimethyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]-N-(2-methylpropyl)pyrazole-4-carboxamide?
N,5-dimethyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]-N-(2-methylpropyl)pyrazole-4-carboxamide has a molecular weight of 353.43 g/mol, XLogP of 3.27, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]-N-(2-methylpropyl)pyrazole-4-carboxamide is sourced from PubChem (CID 26349683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).