N-[1-[3-(2-phenylhydrazinyl)butyl]piperidin-4-yl]benzamide

C22H30N4O — CID 21395239

IUPACN-[1-[3-(2-phenylhydrazinyl)butyl]piperidin-4-yl]benzamide
SMILESCC(CCN1CCC(NC(=O)c2ccccc2)CC1)NNc1ccccc1
InChIInChI=1S/C22H30N4O/c1-18(24-25-21-10-6-3-7-11-21)12-15-26-16-13-20(14-17-26)23-22(27)19-8-4-2-5-9-19/h2-11,18,20,24-25H,12-17H2,1H3,(H,23,27)
InChIKeySNIPSUWGHTWOGD-UHFFFAOYSA-N
MW366.51 g/mol
LogP3.28
Rot. Bonds8

About N-[1-[3-(2-phenylhydrazinyl)butyl]piperidin-4-yl]benzamide

N-[1-[3-(2-phenylhydrazinyl)butyl]piperidin-4-yl]benzamide (PubChem CID 21395239) has the molecular formula C22H30N4O and a molecular weight of 366.51 g/mol. Its IUPAC name is N-[1-[3-(2-phenylhydrazinyl)butyl]piperidin-4-yl]benzamide.

Molecular Properties

Compound NameN-[1-[3-(2-phenylhydrazinyl)butyl]piperidin-4-yl]benzamide
PubChem CID21395239
Molecular FormulaC22H30N4O
Molecular Weight366.51 g/mol
Exact Mass366.24
IUPAC NameN-[1-[3-(2-phenylhydrazinyl)butyl]piperidin-4-yl]benzamide
SMILESCC(CCN1CCC(NC(=O)c2ccccc2)CC1)NNc1ccccc1
InChIInChI=1S/C22H30N4O/c1-18(24-25-21-10-6-3-7-11-21)12-15-26-16-13-20(14-17-26)23-22(27)19-8-4-2-5-9-19/h2-11,18,20,24-25H,12-17H2,1H3,(H,23,27)
InChIKeySNIPSUWGHTWOGD-UHFFFAOYSA-N
XLogP3.28
TPSA56.40 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 53.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[1-[2-oxo-2-(pentan-2-ylamino)ethyl]piperidin-4-yl]benzamide
CID 18131571
N-[1-(2-cyclohexylethyl)piperidin-4-yl]benzamide
CID 21413269
N-[1-(4-anilino-4-oxobutyl)piperidin-4-yl]benzamide
CID 57114875
ethane;N-(1-methylpiperidin-4-yl)benzamide
CID 142009687
N-[1-[2-(3,4-dimethylphenyl)ethyl]piperidin-4-yl]benzamide
CID 21413261
N-[1-[2-(4-chlorophenyl)ethyl]piperidin-4-yl]benzamide
CID 21413251
N-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]benzamide
CID 33103457
N-[1-[(4-methylphenyl)methyl]piperidin-4-yl]benzamide
CID 2729497
N-(1-benzylpiperidin-4-yl)-4-propan-2-ylbenzamide
CID 26681867
N-[1-(4-amino-4-oxobutyl)piperidin-4-yl]benzamide;methyl 4-(4-benzamidopiperidin-1-yl)butanoate
CID 21434692
N-[4-[[1-(2-anilino-2-oxoethyl)piperidin-4-yl]amino]-4-oxobutan-2-yl]benzamide
CID 24629855
N-[1-[2-(methylamino)acetyl]piperidin-4-yl]benzamide
CID 119698218

Frequently Asked Questions

What is the IUPAC name of N-[1-[3-(2-phenylhydrazinyl)butyl]piperidin-4-yl]benzamide?
The IUPAC name of N-[1-[3-(2-phenylhydrazinyl)butyl]piperidin-4-yl]benzamide (CID 21395239) is N-[1-[3-(2-phenylhydrazinyl)butyl]piperidin-4-yl]benzamide.
What is the SMILES notation for N-[1-[3-(2-phenylhydrazinyl)butyl]piperidin-4-yl]benzamide?
The canonical SMILES for N-[1-[3-(2-phenylhydrazinyl)butyl]piperidin-4-yl]benzamide is CC(CCN1CCC(NC(=O)c2ccccc2)CC1)NNc1ccccc1.
What is the InChIKey of N-[1-[3-(2-phenylhydrazinyl)butyl]piperidin-4-yl]benzamide?
The InChIKey is SNIPSUWGHTWOGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N4O/c1-18(24-25-21-10-6-3-7-11-21)12-15-26-16-13-20(14-17-26)23-22(27)19-8-4-2-5-9-19/h2-11,18,20,24-25H,12-17H2,1H3,(H,23,27).
What are the key properties of N-[1-[3-(2-phenylhydrazinyl)butyl]piperidin-4-yl]benzamide?
N-[1-[3-(2-phenylhydrazinyl)butyl]piperidin-4-yl]benzamide has a molecular weight of 366.51 g/mol, XLogP of 3.28, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[3-(2-phenylhydrazinyl)butyl]piperidin-4-yl]benzamide is sourced from PubChem (CID 21395239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).