N-methyl-4-[(5-methyl-1H-pyrazol-4-yl)methylamino]benzamide

C13H16N4O — CID 43683696

IUPACN-methyl-4-[(5-methyl-1H-pyrazol-4-yl)methylamino]benzamide
SMILESCNC(=O)c1ccc(NCc2cn[nH]c2C)cc1
InChIInChI=1S/C13H16N4O/c1-9-11(8-16-17-9)7-15-12-5-3-10(4-6-12)13(18)14-2/h3-6,8,15H,7H2,1-2H3,(H,14,18)(H,16,17)
InChIKeyVOECKCXSKYTUGX-UHFFFAOYSA-N
MW244.30 g/mol
LogP1.69
Rot. Bonds4

About N-methyl-4-[(5-methyl-1H-pyrazol-4-yl)methylamino]benzamide

N-methyl-4-[(5-methyl-1H-pyrazol-4-yl)methylamino]benzamide (PubChem CID 43683696) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is N-methyl-4-[(5-methyl-1H-pyrazol-4-yl)methylamino]benzamide.

Molecular Properties

Compound NameN-methyl-4-[(5-methyl-1H-pyrazol-4-yl)methylamino]benzamide
PubChem CID43683696
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC NameN-methyl-4-[(5-methyl-1H-pyrazol-4-yl)methylamino]benzamide
SMILESCNC(=O)c1ccc(NCc2cn[nH]c2C)cc1
InChIInChI=1S/C13H16N4O/c1-9-11(8-16-17-9)7-15-12-5-3-10(4-6-12)13(18)14-2/h3-6,8,15H,7H2,1-2H3,(H,14,18)(H,16,17)
InChIKeyVOECKCXSKYTUGX-UHFFFAOYSA-N
XLogP1.69
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 51.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-methyl-4-[(5-methyl-1H-pyrazol-4-yl)methylamino]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

4-[(5-methyl-1H-pyrazol-4-yl)methylamino]benzamide
CID 43663501
N-methyl-4-[[5-(trifluoromethyl)-1H-pyrazol-4-yl]methylamino]benzamide
CID 174740416
tert-butyl N-[4-[(5-methyl-1H-pyrazol-4-yl)methylamino]phenyl]carbamate
CID 103818455
N-[4-[(5-methyl-1H-pyrazol-4-yl)methylamino]phenyl]cyclopropanecarboxamide
CID 43663626
4-(2-methoxyethoxy)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]aniline
CID 43734233
N-[(5-methyl-1H-pyrazol-4-yl)methyl]-4-propan-2-yloxyaniline
CID 43663707
[4-[(5-methyl-1H-pyrazol-4-yl)methylamino]phenyl]methanesulfonamide
CID 43745275
N-methyl-4-[(2,3,4-trihydroxyphenyl)methylamino]benzamide
CID 107730574
4-[(5-methyl-1H-pyrazol-4-yl)methylamino]benzene-1,2-dicarbonitrile
CID 107788411
1-methyl-5-[(5-methyl-1H-pyrazol-4-yl)methylamino]pyridin-2-one
CID 60932541
3-bromo-4-fluoro-N-[(5-methyl-1H-pyrazol-4-yl)methyl]aniline
CID 115909467
N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridin-3-amine
CID 43663437

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[(5-methyl-1H-pyrazol-4-yl)methylamino]benzamide?
The IUPAC name of N-methyl-4-[(5-methyl-1H-pyrazol-4-yl)methylamino]benzamide (CID 43683696) is N-methyl-4-[(5-methyl-1H-pyrazol-4-yl)methylamino]benzamide.
What is the SMILES notation for N-methyl-4-[(5-methyl-1H-pyrazol-4-yl)methylamino]benzamide?
The canonical SMILES for N-methyl-4-[(5-methyl-1H-pyrazol-4-yl)methylamino]benzamide is CNC(=O)c1ccc(NCc2cn[nH]c2C)cc1.
What is the InChIKey of N-methyl-4-[(5-methyl-1H-pyrazol-4-yl)methylamino]benzamide?
The InChIKey is VOECKCXSKYTUGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O/c1-9-11(8-16-17-9)7-15-12-5-3-10(4-6-12)13(18)14-2/h3-6,8,15H,7H2,1-2H3,(H,14,18)(H,16,17).
What are the key properties of N-methyl-4-[(5-methyl-1H-pyrazol-4-yl)methylamino]benzamide?
N-methyl-4-[(5-methyl-1H-pyrazol-4-yl)methylamino]benzamide has a molecular weight of 244.30 g/mol, XLogP of 1.69, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[(5-methyl-1H-pyrazol-4-yl)methylamino]benzamide is sourced from PubChem (CID 43683696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).