3-(2-methoxyethoxy)-N-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide

C16H21N3O3 — CID 126820356

IUPAC3-(2-methoxyethoxy)-N-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide
SMILESCOCCOc1cccc(C(=O)N(C)Cc2cn[nH]c2C)c1
InChIInChI=1S/C16H21N3O3/c1-12-14(10-17-18-12)11-19(2)16(20)13-5-4-6-15(9-13)22-8-7-21-3/h4-6,9-10H,7-8,11H2,1-3H3,(H,17,18)
InChIKeyQSSLXIZOIMXACF-UHFFFAOYSA-N
MW303.36 g/mol
LogP2.02
Rot. Bonds7

About 3-(2-methoxyethoxy)-N-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide

3-(2-methoxyethoxy)-N-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide (PubChem CID 126820356) has the molecular formula C16H21N3O3 and a molecular weight of 303.36 g/mol. Its IUPAC name is 3-(2-methoxyethoxy)-N-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide.

Molecular Properties

Compound Name3-(2-methoxyethoxy)-N-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide
PubChem CID126820356
Molecular FormulaC16H21N3O3
Molecular Weight303.36 g/mol
Exact Mass303.16
IUPAC Name3-(2-methoxyethoxy)-N-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide
SMILESCOCCOc1cccc(C(=O)N(C)Cc2cn[nH]c2C)c1
InChIInChI=1S/C16H21N3O3/c1-12-14(10-17-18-12)11-19(2)16(20)13-5-4-6-15(9-13)22-8-7-21-3/h4-6,9-10H,7-8,11H2,1-3H3,(H,17,18)
InChIKeyQSSLXIZOIMXACF-UHFFFAOYSA-N
XLogP2.02
TPSA67.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.36
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 3-(2-methoxyethoxy)-N-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide 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-benzyl-N-methyl-3-(2-phenylethoxy)benzamide
CID 17134261
N-[(2-bromophenyl)methyl]-N-methyl-3-propoxybenzamide
CID 55770837
3-(2-methoxyethoxy)-N-methyl-N-piperidin-4-ylbenzamide
CID 119441131
N-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-3,4-dihydro-2H-chromene-6-carboxamide
CID 131913448
N-(1H-indazol-7-ylmethyl)-N-methyl-5-propoxypyridine-3-carboxamide
CID 165385295
3-methoxy-N-methyl-N-[(5-methyl-1H-1,2,4-triazol-3-yl)methyl]benzamide
CID 64511572
2-(3-acetylphenoxy)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]propanamide
CID 51102404
N-(2-aminoethyl)-3-(2-methoxyethoxy)benzamide
CID 119381991
3-[2-(dimethylamino)-2-oxoethoxy]-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide
CID 55770594
N-[(2-chlorophenyl)methyl]-N-ethyl-3-(2-methoxyethoxy)benzamide
CID 60566746
3-methoxy-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide
CID 22070414
3-(3-methoxypropoxy)-N-methyl-N-piperidin-4-ylbenzamide;hydrochloride
CID 119441938

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethoxy)-N-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide?
The IUPAC name of 3-(2-methoxyethoxy)-N-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide (CID 126820356) is 3-(2-methoxyethoxy)-N-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide.
What is the SMILES notation for 3-(2-methoxyethoxy)-N-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide?
The canonical SMILES for 3-(2-methoxyethoxy)-N-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide is COCCOc1cccc(C(=O)N(C)Cc2cn[nH]c2C)c1.
What is the InChIKey of 3-(2-methoxyethoxy)-N-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide?
The InChIKey is QSSLXIZOIMXACF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O3/c1-12-14(10-17-18-12)11-19(2)16(20)13-5-4-6-15(9-13)22-8-7-21-3/h4-6,9-10H,7-8,11H2,1-3H3,(H,17,18).
What are the key properties of 3-(2-methoxyethoxy)-N-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide?
3-(2-methoxyethoxy)-N-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide has a molecular weight of 303.36 g/mol, XLogP of 2.02, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethoxy)-N-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide is sourced from PubChem (CID 126820356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).