1-[(2,3-dichlorophenoxy)methyl]-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide

C17H20Cl2N4O3 — CID 19269771

IUPAC1-[(2,3-dichlorophenoxy)methyl]-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide
SMILESO=C(NCCN1CCOCC1)c1ccn(COc2cccc(Cl)c2Cl)n1
InChIInChI=1S/C17H20Cl2N4O3/c18-13-2-1-3-15(16(13)19)26-12-23-6-4-14(21-23)17(24)20-5-7-22-8-10-25-11-9-22/h1-4,6H,5,7-12H2,(H,20,24)
InChIKeyUIMUTXRWSLVFPZ-UHFFFAOYSA-N
MW399.28 g/mol
LogP2.29
Rot. Bonds7

About 1-[(2,3-dichlorophenoxy)methyl]-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide

1-[(2,3-dichlorophenoxy)methyl]-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide (PubChem CID 19269771) has the molecular formula C17H20Cl2N4O3 and a molecular weight of 399.28 g/mol. Its IUPAC name is 1-[(2,3-dichlorophenoxy)methyl]-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name1-[(2,3-dichlorophenoxy)methyl]-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide
PubChem CID19269771
Molecular FormulaC17H20Cl2N4O3
Molecular Weight399.28 g/mol
Exact Mass398.09
IUPAC Name1-[(2,3-dichlorophenoxy)methyl]-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide
SMILESO=C(NCCN1CCOCC1)c1ccn(COc2cccc(Cl)c2Cl)n1
InChIInChI=1S/C17H20Cl2N4O3/c18-13-2-1-3-15(16(13)19)26-12-23-6-4-14(21-23)17(24)20-5-7-22-8-10-25-11-9-22/h1-4,6H,5,7-12H2,(H,20,24)
InChIKeyUIMUTXRWSLVFPZ-UHFFFAOYSA-N
XLogP2.29
TPSA68.62 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.28
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-[(2,3-dichlorophenoxy)methyl]-N-(2-morpholin-4-ylethyl)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

Related Compounds

1-(methoxymethyl)-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide
CID 19270984
1-[(2,3-dichlorophenoxy)methyl]-N-phenylpyrazole-3-carboxamide
CID 19269594
1-[(2,3-dichlorophenoxy)methyl]-N-[2-(5-methyl-3-nitropyrazol-1-yl)ethyl]pyrazole-3-carboxamide
CID 19283215
N-[(4-chloro-1-methylpyrazol-5-yl)methyl]-1-[(2,3-dichlorophenoxy)methyl]pyrazole-3-carboxamide
CID 19322885
N-(3-morpholin-4-ylpropyl)-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide
CID 19273397
5-(2,6-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 109185766
1-[(2-chlorophenoxy)methyl]-N-[[4-(pyrrolidin-1-ylmethyl)oxan-4-yl]methyl]pyrazole-3-carboxamide
CID 91957557
1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide
CID 19262651
1-[(2,3-dichlorophenoxy)methyl]-N-(2,5-dimethylphenyl)pyrazole-3-carboxamide
CID 19269620
N-(5-chloro-2-methylphenyl)-1-[(2,3-dichlorophenoxy)methyl]pyrazole-3-carboxamide
CID 19269515
1-[(2,6-dichlorophenoxy)methyl]-N-(2-hydroxyethyl)pyrazole-3-carboxamide
CID 19269884
1-[(2,3-dichlorophenoxy)methyl]-N-(1,1-dioxothiolan-3-yl)pyrazole-3-carboxamide
CID 45147719

Frequently Asked Questions

What is the IUPAC name of 1-[(2,3-dichlorophenoxy)methyl]-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide?
The IUPAC name of 1-[(2,3-dichlorophenoxy)methyl]-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide (CID 19269771) is 1-[(2,3-dichlorophenoxy)methyl]-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide.
What is the SMILES notation for 1-[(2,3-dichlorophenoxy)methyl]-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide?
The canonical SMILES for 1-[(2,3-dichlorophenoxy)methyl]-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide is O=C(NCCN1CCOCC1)c1ccn(COc2cccc(Cl)c2Cl)n1.
What is the InChIKey of 1-[(2,3-dichlorophenoxy)methyl]-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide?
The InChIKey is UIMUTXRWSLVFPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20Cl2N4O3/c18-13-2-1-3-15(16(13)19)26-12-23-6-4-14(21-23)17(24)20-5-7-22-8-10-25-11-9-22/h1-4,6H,5,7-12H2,(H,20,24).
What are the key properties of 1-[(2,3-dichlorophenoxy)methyl]-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide?
1-[(2,3-dichlorophenoxy)methyl]-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide has a molecular weight of 399.28 g/mol, XLogP of 2.29, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,3-dichlorophenoxy)methyl]-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide is sourced from PubChem (CID 19269771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).