3-methoxy-N-methyl-N-[(2-methylpyrazol-3-yl)methyl]benzamide

C14H17N3O2 — CID 19458189

IUPAC3-methoxy-N-methyl-N-[(2-methylpyrazol-3-yl)methyl]benzamide
SMILESCOc1cccc(C(=O)N(C)Cc2ccnn2C)c1
InChIInChI=1S/C14H17N3O2/c1-16(10-12-7-8-15-17(12)2)14(18)11-5-4-6-13(9-11)19-3/h4-9H,10H2,1-3H3
InChIKeyMQUPDVJHXBCTNB-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.70
Rot. Bonds4

About 3-methoxy-N-methyl-N-[(2-methylpyrazol-3-yl)methyl]benzamide

3-methoxy-N-methyl-N-[(2-methylpyrazol-3-yl)methyl]benzamide (PubChem CID 19458189) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 3-methoxy-N-methyl-N-[(2-methylpyrazol-3-yl)methyl]benzamide.

Molecular Properties

Compound Name3-methoxy-N-methyl-N-[(2-methylpyrazol-3-yl)methyl]benzamide
PubChem CID19458189
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name3-methoxy-N-methyl-N-[(2-methylpyrazol-3-yl)methyl]benzamide
SMILESCOc1cccc(C(=O)N(C)Cc2ccnn2C)c1
InChIInChI=1S/C14H17N3O2/c1-16(10-12-7-8-15-17(12)2)14(18)11-5-4-6-13(9-11)19-3/h4-9H,10H2,1-3H3
InChIKeyMQUPDVJHXBCTNB-UHFFFAOYSA-N
XLogP1.70
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-methoxy-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide
CID 22070414
N-ethyl-3-methoxy-N-methylbenzamide
CID 15816607
3-[(2,4-dichlorophenoxy)methyl]-N-methyl-N-[(2-methylpyrazol-3-yl)methyl]benzamide
CID 19458220
3-[(4-chlorophenoxy)methyl]-4-methoxy-N-methyl-N-[(2-methylpyrazol-3-yl)methyl]benzamide
CID 19458228
N-[(2-ethylpyrazol-3-yl)methyl]-N-methyl-3-(2,2,2-trifluoroethoxy)benzamide
CID 19454355
3-methoxy-N-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
CID 113095830
3-methoxy-N-methyl-N-[(5-methyl-1H-1,2,4-triazol-3-yl)methyl]benzamide
CID 64511572
3-[(3-bromophenoxy)methyl]-N-[(2-ethylpyrazol-3-yl)methyl]-N-methylbenzamide
CID 19454293
4-[(4-chlorophenoxy)methyl]-N-methyl-N-[(2-methylpyrazol-3-yl)methyl]benzamide
CID 19458304
N-[(5-bromothiophen-3-yl)methyl]-3-methoxy-N-methylbenzamide
CID 54983997
N-[(3-fluoro-4-methoxyphenyl)methyl]-3-methoxy-N-methylbenzamide
CID 78796913
3-methoxy-N-methyl-N-[(3-methyl-5-oxo-2H-oxadiazol-3-ium-4-yl)methyl]benzamide
CID 53289812

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-methyl-N-[(2-methylpyrazol-3-yl)methyl]benzamide?
The IUPAC name of 3-methoxy-N-methyl-N-[(2-methylpyrazol-3-yl)methyl]benzamide (CID 19458189) is 3-methoxy-N-methyl-N-[(2-methylpyrazol-3-yl)methyl]benzamide.
What is the SMILES notation for 3-methoxy-N-methyl-N-[(2-methylpyrazol-3-yl)methyl]benzamide?
The canonical SMILES for 3-methoxy-N-methyl-N-[(2-methylpyrazol-3-yl)methyl]benzamide is COc1cccc(C(=O)N(C)Cc2ccnn2C)c1.
What is the InChIKey of 3-methoxy-N-methyl-N-[(2-methylpyrazol-3-yl)methyl]benzamide?
The InChIKey is MQUPDVJHXBCTNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-16(10-12-7-8-15-17(12)2)14(18)11-5-4-6-13(9-11)19-3/h4-9H,10H2,1-3H3.
What are the key properties of 3-methoxy-N-methyl-N-[(2-methylpyrazol-3-yl)methyl]benzamide?
3-methoxy-N-methyl-N-[(2-methylpyrazol-3-yl)methyl]benzamide has a molecular weight of 259.31 g/mol, XLogP of 1.70, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-methyl-N-[(2-methylpyrazol-3-yl)methyl]benzamide is sourced from PubChem (CID 19458189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).