3-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(piperidin-3-ylmethyl)benzamide

C19H26N4O — CID 119461459

IUPAC3-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(piperidin-3-ylmethyl)benzamide
SMILESCc1cc(C)n(Cc2cccc(C(=O)NCC3CCCNC3)c2)n1
InChIInChI=1S/C19H26N4O/c1-14-9-15(2)23(22-14)13-16-5-3-7-18(10-16)19(24)21-12-17-6-4-8-20-11-17/h3,5,7,9-10,17,20H,4,6,8,11-13H2,1-2H3,(H,21,24)
InChIKeyHYCVQIFAWLISPZ-UHFFFAOYSA-N
MW326.44 g/mol
LogP2.28
Rot. Bonds5

About 3-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(piperidin-3-ylmethyl)benzamide

3-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(piperidin-3-ylmethyl)benzamide (PubChem CID 119461459) has the molecular formula C19H26N4O and a molecular weight of 326.44 g/mol. Its IUPAC name is 3-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(piperidin-3-ylmethyl)benzamide.

Molecular Properties

Compound Name3-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(piperidin-3-ylmethyl)benzamide
PubChem CID119461459
Molecular FormulaC19H26N4O
Molecular Weight326.44 g/mol
Exact Mass326.21
IUPAC Name3-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(piperidin-3-ylmethyl)benzamide
SMILESCc1cc(C)n(Cc2cccc(C(=O)NCC3CCCNC3)c2)n1
InChIInChI=1S/C19H26N4O/c1-14-9-15(2)23(22-14)13-16-5-3-7-18(10-16)19(24)21-12-17-6-4-8-20-11-17/h3,5,7,9-10,17,20H,4,6,8,11-13H2,1-2H3,(H,21,24)
InChIKeyHYCVQIFAWLISPZ-UHFFFAOYSA-N
XLogP2.28
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(piperidin-3-ylmethyl)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

3-[(3,5-dimethylpyrazol-1-yl)methyl]-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119451087
3-[(3,5-dimethylpyrazol-1-yl)methyl]-N-[(1,1-dioxothiolan-3-yl)methyl]benzamide
CID 51128124
3-[(3,5-dimethylpyrazol-1-yl)methyl]-N-[[(2S)-oxan-2-yl]methyl]benzamide
CID 95595180
3-[(3,5-dimethylpyrazol-1-yl)methyl]-N-[(1-hydroxycyclopentyl)methyl]benzamide
CID 111331403
3-N-(piperidin-3-ylmethyl)benzene-1,3-dicarboxamide;hydrochloride
CID 119463124
N-(8-azabicyclo[3.2.1]octan-3-yl)-3-[(3,5-dimethylpyrazol-1-yl)methyl]benzamide
CID 119456634
N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119461032
3-iodo-4-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 119464322
[3-[(3,5-dimethylpyrazol-1-yl)methyl]phenyl]-[4-(ethylaminomethyl)piperidin-1-yl]methanone
CID 119645620
N-(piperidin-3-ylmethyl)quinoline-6-carboxamide
CID 62874382
5-[[[3-[(3,5-dimethylpyrazol-1-yl)methyl]benzoyl]amino]methyl]-2-methylfuran-3-carboxylic acid
CID 119226807
1-methyl-2-oxo-N-(piperidin-3-ylmethyl)pyridine-4-carboxamide
CID 103793639

Frequently Asked Questions

What is the IUPAC name of 3-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(piperidin-3-ylmethyl)benzamide?
The IUPAC name of 3-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(piperidin-3-ylmethyl)benzamide (CID 119461459) is 3-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(piperidin-3-ylmethyl)benzamide.
What is the SMILES notation for 3-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(piperidin-3-ylmethyl)benzamide?
The canonical SMILES for 3-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(piperidin-3-ylmethyl)benzamide is Cc1cc(C)n(Cc2cccc(C(=O)NCC3CCCNC3)c2)n1.
What is the InChIKey of 3-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(piperidin-3-ylmethyl)benzamide?
The InChIKey is HYCVQIFAWLISPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O/c1-14-9-15(2)23(22-14)13-16-5-3-7-18(10-16)19(24)21-12-17-6-4-8-20-11-17/h3,5,7,9-10,17,20H,4,6,8,11-13H2,1-2H3,(H,21,24).
What are the key properties of 3-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(piperidin-3-ylmethyl)benzamide?
3-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(piperidin-3-ylmethyl)benzamide has a molecular weight of 326.44 g/mol, XLogP of 2.28, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(piperidin-3-ylmethyl)benzamide is sourced from PubChem (CID 119461459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).