N-[(1-piperidin-1-ylcyclohexyl)methyl]-4-pyrazol-1-ylbenzamide

C22H30N4O — CID 9291996

IUPACN-[(1-piperidin-1-ylcyclohexyl)methyl]-4-pyrazol-1-ylbenzamide
SMILESO=C(NCC1(N2CCCCC2)CCCCC1)c1ccc(-n2cccn2)cc1
InChIInChI=1S/C22H30N4O/c27-21(19-8-10-20(11-9-19)26-17-7-14-24-26)23-18-22(12-3-1-4-13-22)25-15-5-2-6-16-25/h7-11,14,17H,1-6,12-13,15-16,18H2,(H,23,27)
InChIKeyUUAMNEFCKPCNII-UHFFFAOYSA-N
MW366.51 g/mol
LogP3.79
Rot. Bonds5

About N-[(1-piperidin-1-ylcyclohexyl)methyl]-4-pyrazol-1-ylbenzamide

N-[(1-piperidin-1-ylcyclohexyl)methyl]-4-pyrazol-1-ylbenzamide (PubChem CID 9291996) has the molecular formula C22H30N4O and a molecular weight of 366.51 g/mol. Its IUPAC name is N-[(1-piperidin-1-ylcyclohexyl)methyl]-4-pyrazol-1-ylbenzamide.

Molecular Properties

Compound NameN-[(1-piperidin-1-ylcyclohexyl)methyl]-4-pyrazol-1-ylbenzamide
PubChem CID9291996
Molecular FormulaC22H30N4O
Molecular Weight366.51 g/mol
Exact Mass366.24
IUPAC NameN-[(1-piperidin-1-ylcyclohexyl)methyl]-4-pyrazol-1-ylbenzamide
SMILESO=C(NCC1(N2CCCCC2)CCCCC1)c1ccc(-n2cccn2)cc1
InChIInChI=1S/C22H30N4O/c27-21(19-8-10-20(11-9-19)26-17-7-14-24-26)23-18-22(12-3-1-4-13-22)25-15-5-2-6-16-25/h7-11,14,17H,1-6,12-13,15-16,18H2,(H,23,27)
InChIKeyUUAMNEFCKPCNII-UHFFFAOYSA-N
XLogP3.79
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(1-piperidin-1-ylcyclohexyl)methyl]-4-pyrazol-1-ylbenzamide 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-piperidin-1-yl-N-[(1-pyrrolidin-1-ylcyclopentyl)methyl]benzamide
CID 91760256
4-morpholin-4-yl-N-[(1-pyrrolidin-1-ylcyclohexyl)methyl]benzamide
CID 91792119
4-(4-methylpiperidin-1-yl)-N-[(1-piperidin-1-ylcyclohexyl)methyl]benzamide
CID 46951890
N-(3-oxo-3-pyrrolidin-1-ylpropyl)-4-pyrazol-1-ylbenzamide
CID 18157119
N-[(4-piperidin-1-yloxan-4-yl)methyl]-2-pyrazol-1-ylpyridine-4-carboxamide
CID 154737203
N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]-4-pyrazol-1-ylbenzamide
CID 9069207
N-prop-2-ynyl-4-pyrazol-1-ylbenzamide
CID 30601389
4-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide
CID 2559826
N-[(1-piperidin-1-ylcyclohexyl)methyl]pyrazine-2-carboxamide
CID 17447495
2-pyridin-3-yl-N-[(1-pyrrolidin-1-ylcyclohexyl)methyl]acetamide
CID 91780791
4-(2-methylsulfanylimidazol-1-yl)-N-[(1-thiomorpholin-4-ylcyclopentyl)methyl]benzamide
CID 55777798
2-methyl-1-[(1-morpholin-4-ylcyclohexyl)methyl]-3-[(4-pyrazol-1-ylphenyl)methyl]guanidine
CID 111003487

Frequently Asked Questions

What is the IUPAC name of N-[(1-piperidin-1-ylcyclohexyl)methyl]-4-pyrazol-1-ylbenzamide?
The IUPAC name of N-[(1-piperidin-1-ylcyclohexyl)methyl]-4-pyrazol-1-ylbenzamide (CID 9291996) is N-[(1-piperidin-1-ylcyclohexyl)methyl]-4-pyrazol-1-ylbenzamide.
What is the SMILES notation for N-[(1-piperidin-1-ylcyclohexyl)methyl]-4-pyrazol-1-ylbenzamide?
The canonical SMILES for N-[(1-piperidin-1-ylcyclohexyl)methyl]-4-pyrazol-1-ylbenzamide is O=C(NCC1(N2CCCCC2)CCCCC1)c1ccc(-n2cccn2)cc1.
What is the InChIKey of N-[(1-piperidin-1-ylcyclohexyl)methyl]-4-pyrazol-1-ylbenzamide?
The InChIKey is UUAMNEFCKPCNII-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N4O/c27-21(19-8-10-20(11-9-19)26-17-7-14-24-26)23-18-22(12-3-1-4-13-22)25-15-5-2-6-16-25/h7-11,14,17H,1-6,12-13,15-16,18H2,(H,23,27).
What are the key properties of N-[(1-piperidin-1-ylcyclohexyl)methyl]-4-pyrazol-1-ylbenzamide?
N-[(1-piperidin-1-ylcyclohexyl)methyl]-4-pyrazol-1-ylbenzamide has a molecular weight of 366.51 g/mol, XLogP of 3.79, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-piperidin-1-ylcyclohexyl)methyl]-4-pyrazol-1-ylbenzamide is sourced from PubChem (CID 9291996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).