N-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2-phenylacetamide

C14H17N3O — CID 19452057

IUPACN-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2-phenylacetamide
SMILESCN(Cc1ccn(C)n1)C(=O)Cc1ccccc1
InChIInChI=1S/C14H17N3O/c1-16(11-13-8-9-17(2)15-13)14(18)10-12-6-4-3-5-7-12/h3-9H,10-11H2,1-2H3
InChIKeyTVDQJPIZUUCBGI-UHFFFAOYSA-N
MW243.31 g/mol
LogP1.62
Rot. Bonds4

About N-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2-phenylacetamide

N-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2-phenylacetamide (PubChem CID 19452057) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is N-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2-phenylacetamide
PubChem CID19452057
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC NameN-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2-phenylacetamide
SMILESCN(Cc1ccn(C)n1)C(=O)Cc1ccccc1
InChIInChI=1S/C14H17N3O/c1-16(11-13-8-9-17(2)15-13)14(18)10-12-6-4-3-5-7-12/h3-9H,10-11H2,1-2H3
InChIKeyTVDQJPIZUUCBGI-UHFFFAOYSA-N
XLogP1.62
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[methyl-[(1-methylpyrazol-3-yl)methyl]amino]-4-oxobutanoic acid
CID 19620319
2-iodo-N-methyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide
CID 19452041
N-methyl-2-phenyl-N-[(4-phenylphenyl)methyl]acetamide
CID 55580695
N-methyl-2-phenyl-N-(pyridin-3-ylmethyl)acetamide
CID 110724689
N-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2-nitrobenzamide
CID 19452047
N-benzyl-N-methyl-2-(4-sulfanylphenyl)acetamide
CID 107020688
N-[(2-ethylpyrazol-3-yl)methyl]-N-methyl-2-phenylacetamide
CID 19454252
N-methyl-2-[4-methyl-3,5-bis(4-methylphenyl)pyrazol-1-yl]-N-[(1-methylpyrazol-3-yl)methyl]acetamide
CID 19588309
1-hydroxy-3-(1-methylpyrazol-3-yl)-1-phenylpropan-2-one
CID 103458285
1-methyl-1-[(1-methylpyrazol-3-yl)methyl]hydrazine
CID 123416642
N-methyl-N-[(1-methylpyrazol-3-yl)methyl]-3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanamide
CID 19452152
3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-methyl-N-[(1-methylpyrazol-3-yl)methyl]propanamide
CID 19452153

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2-phenylacetamide?
The IUPAC name of N-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2-phenylacetamide (CID 19452057) is N-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2-phenylacetamide.
What is the SMILES notation for N-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2-phenylacetamide?
The canonical SMILES for N-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2-phenylacetamide is CN(Cc1ccn(C)n1)C(=O)Cc1ccccc1.
What is the InChIKey of N-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2-phenylacetamide?
The InChIKey is TVDQJPIZUUCBGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-16(11-13-8-9-17(2)15-13)14(18)10-12-6-4-3-5-7-12/h3-9H,10-11H2,1-2H3.
What are the key properties of N-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2-phenylacetamide?
N-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2-phenylacetamide has a molecular weight of 243.31 g/mol, XLogP of 1.62, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2-phenylacetamide is sourced from PubChem (CID 19452057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).