N-[[1-[2-(3-methylpyrazol-1-yl)ethyl]piperidin-4-yl]methyl]benzamide

C19H26N4O — CID 131907713

IUPACN-[[1-[2-(3-methylpyrazol-1-yl)ethyl]piperidin-4-yl]methyl]benzamide
SMILESCc1ccn(CCN2CCC(CNC(=O)c3ccccc3)CC2)n1
InChIInChI=1S/C19H26N4O/c1-16-7-12-23(21-16)14-13-22-10-8-17(9-11-22)15-20-19(24)18-5-3-2-4-6-18/h2-7,12,17H,8-11,13-15H2,1H3,(H,20,24)
InChIKeyVMEPENOETDSBLD-UHFFFAOYSA-N
MW326.44 g/mol
LogP2.33
Rot. Bonds6

About N-[[1-[2-(3-methylpyrazol-1-yl)ethyl]piperidin-4-yl]methyl]benzamide

N-[[1-[2-(3-methylpyrazol-1-yl)ethyl]piperidin-4-yl]methyl]benzamide (PubChem CID 131907713) has the molecular formula C19H26N4O and a molecular weight of 326.44 g/mol. Its IUPAC name is N-[[1-[2-(3-methylpyrazol-1-yl)ethyl]piperidin-4-yl]methyl]benzamide.

Molecular Properties

Compound NameN-[[1-[2-(3-methylpyrazol-1-yl)ethyl]piperidin-4-yl]methyl]benzamide
PubChem CID131907713
Molecular FormulaC19H26N4O
Molecular Weight326.44 g/mol
Exact Mass326.21
IUPAC NameN-[[1-[2-(3-methylpyrazol-1-yl)ethyl]piperidin-4-yl]methyl]benzamide
SMILESCc1ccn(CCN2CCC(CNC(=O)c3ccccc3)CC2)n1
InChIInChI=1S/C19H26N4O/c1-16-7-12-23(21-16)14-13-22-10-8-17(9-11-22)15-20-19(24)18-5-3-2-4-6-18/h2-7,12,17H,8-11,13-15H2,1H3,(H,20,24)
InChIKeyVMEPENOETDSBLD-UHFFFAOYSA-N
XLogP2.33
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[1-[2-(3-methylpyrazol-1-yl)ethyl]piperidin-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-[(1-pent-2-ynylpiperidin-4-yl)methyl]benzamide
CID 131929470
N-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]methyl]benzamide
CID 16896080
N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-6-methylpyridine-3-carboxamide
CID 71880041
1-(4-benzylpiperidin-1-yl)-3-[1-[3-(3-methylpyrazol-1-yl)propanoyl]piperidin-4-yl]propan-1-one
CID 42567654
N-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]benzamide
CID 61245229
4-methoxy-N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]benzamide
CID 16895498
4-bromo-N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]benzamide
CID 16895556
N-[(1-benzylpiperidin-4-yl)methyl]-3-methoxybenzamide
CID 16895714
3-methyl-N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]benzamide
CID 16895986
4-N-phenyl-1-N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]benzene-1,4-dicarboxamide
CID 167930415
N-[(4-bromocyclohexyl)methyl]benzamide
CID 106134088
N-[[1-(2-aminoethyl)piperidin-4-yl]methyl]-3,5-dimethylbenzamide
CID 130216559

Frequently Asked Questions

What is the IUPAC name of N-[[1-[2-(3-methylpyrazol-1-yl)ethyl]piperidin-4-yl]methyl]benzamide?
The IUPAC name of N-[[1-[2-(3-methylpyrazol-1-yl)ethyl]piperidin-4-yl]methyl]benzamide (CID 131907713) is N-[[1-[2-(3-methylpyrazol-1-yl)ethyl]piperidin-4-yl]methyl]benzamide.
What is the SMILES notation for N-[[1-[2-(3-methylpyrazol-1-yl)ethyl]piperidin-4-yl]methyl]benzamide?
The canonical SMILES for N-[[1-[2-(3-methylpyrazol-1-yl)ethyl]piperidin-4-yl]methyl]benzamide is Cc1ccn(CCN2CCC(CNC(=O)c3ccccc3)CC2)n1.
What is the InChIKey of N-[[1-[2-(3-methylpyrazol-1-yl)ethyl]piperidin-4-yl]methyl]benzamide?
The InChIKey is VMEPENOETDSBLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O/c1-16-7-12-23(21-16)14-13-22-10-8-17(9-11-22)15-20-19(24)18-5-3-2-4-6-18/h2-7,12,17H,8-11,13-15H2,1H3,(H,20,24).
What are the key properties of N-[[1-[2-(3-methylpyrazol-1-yl)ethyl]piperidin-4-yl]methyl]benzamide?
N-[[1-[2-(3-methylpyrazol-1-yl)ethyl]piperidin-4-yl]methyl]benzamide has a molecular weight of 326.44 g/mol, XLogP of 2.33, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[2-(3-methylpyrazol-1-yl)ethyl]piperidin-4-yl]methyl]benzamide is sourced from PubChem (CID 131907713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).