1,3-diethyl-N-[(4-hydroxyphenyl)methyl]-N-methylpyrazole-5-carboxamide

C16H21N3O2 — CID 66122171

IUPAC1,3-diethyl-N-[(4-hydroxyphenyl)methyl]-N-methylpyrazole-5-carboxamide
SMILESCCc1cc(C(=O)N(C)Cc2ccc(O)cc2)n(CC)n1
InChIInChI=1S/C16H21N3O2/c1-4-13-10-15(19(5-2)17-13)16(21)18(3)11-12-6-8-14(20)9-7-12/h6-10,20H,4-5,11H2,1-3H3
InChIKeyGDZZVLOSSXDENO-UHFFFAOYSA-N
MW287.36 g/mol
LogP2.44
Rot. Bonds5

About 1,3-diethyl-N-[(4-hydroxyphenyl)methyl]-N-methylpyrazole-5-carboxamide

1,3-diethyl-N-[(4-hydroxyphenyl)methyl]-N-methylpyrazole-5-carboxamide (PubChem CID 66122171) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is 1,3-diethyl-N-[(4-hydroxyphenyl)methyl]-N-methylpyrazole-5-carboxamide.

Molecular Properties

Compound Name1,3-diethyl-N-[(4-hydroxyphenyl)methyl]-N-methylpyrazole-5-carboxamide
PubChem CID66122171
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name1,3-diethyl-N-[(4-hydroxyphenyl)methyl]-N-methylpyrazole-5-carboxamide
SMILESCCc1cc(C(=O)N(C)Cc2ccc(O)cc2)n(CC)n1
InChIInChI=1S/C16H21N3O2/c1-4-13-10-15(19(5-2)17-13)16(21)18(3)11-12-6-8-14(20)9-7-12/h6-10,20H,4-5,11H2,1-3H3
InChIKeyGDZZVLOSSXDENO-UHFFFAOYSA-N
XLogP2.44
TPSA58.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1,3-diethyl-N-[(4-hydroxyphenyl)methyl]-N-methylpyrazole-5-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-[(4-bromophenyl)methyl]-1,3-diethyl-N-methylpyrazole-5-carboxamide
CID 66120211
N-[[3-(aminomethyl)phenyl]methyl]-2-ethyl-N,5-dimethylpyrazole-3-carboxamide
CID 66128449
methyl 3-[(1,3-diethylpyrazole-5-carbonyl)-methylamino]-2-methylpropanoate
CID 66120831
2-[(1,3-diethylpyrazole-5-carbonyl)-ethylamino]acetic acid
CID 66121770
N-(1-aminopropan-2-yl)-1,3-diethyl-N-methylpyrazole-5-carboxamide
CID 104556601
3-ethyl-N-[(4-hydroxyphenyl)methyl]-N-methylthiophene-2-carboxamide
CID 47374320
N-[(4-hydroxyphenyl)methyl]-N-methyl-1-propylpyrrole-2-carboxamide
CID 61044229
N-(8-azabicyclo[3.2.1]octan-3-yl)-1,3-diethyl-N-methylpyrazole-5-carboxamide
CID 66121022
2-[(1,3-diethylpyrazole-5-carbonyl)-propylamino]acetic acid
CID 66121962
2-[(2-amino-2-oxoethyl)-(1,3-diethylpyrazole-5-carbonyl)amino]acetic acid
CID 107434236
N-[(4-hydroxyphenyl)methyl]-N-methylpyrimidine-5-carboxamide
CID 104629381
N-(3-aminopropyl)-N-cyclopropyl-1,3-diethylpyrazole-5-carboxamide
CID 66121370

Frequently Asked Questions

What is the IUPAC name of 1,3-diethyl-N-[(4-hydroxyphenyl)methyl]-N-methylpyrazole-5-carboxamide?
The IUPAC name of 1,3-diethyl-N-[(4-hydroxyphenyl)methyl]-N-methylpyrazole-5-carboxamide (CID 66122171) is 1,3-diethyl-N-[(4-hydroxyphenyl)methyl]-N-methylpyrazole-5-carboxamide.
What is the SMILES notation for 1,3-diethyl-N-[(4-hydroxyphenyl)methyl]-N-methylpyrazole-5-carboxamide?
The canonical SMILES for 1,3-diethyl-N-[(4-hydroxyphenyl)methyl]-N-methylpyrazole-5-carboxamide is CCc1cc(C(=O)N(C)Cc2ccc(O)cc2)n(CC)n1.
What is the InChIKey of 1,3-diethyl-N-[(4-hydroxyphenyl)methyl]-N-methylpyrazole-5-carboxamide?
The InChIKey is GDZZVLOSSXDENO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-4-13-10-15(19(5-2)17-13)16(21)18(3)11-12-6-8-14(20)9-7-12/h6-10,20H,4-5,11H2,1-3H3.
What are the key properties of 1,3-diethyl-N-[(4-hydroxyphenyl)methyl]-N-methylpyrazole-5-carboxamide?
1,3-diethyl-N-[(4-hydroxyphenyl)methyl]-N-methylpyrazole-5-carboxamide has a molecular weight of 287.36 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-diethyl-N-[(4-hydroxyphenyl)methyl]-N-methylpyrazole-5-carboxamide is sourced from PubChem (CID 66122171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).