N-[1-[2-[4-(2-methylcyclobutyl)piperazin-1-yl]-2-oxoethyl]piperidin-4-yl]benzamide

C23H34N4O2 — CID 143404085

IUPACN-[1-[2-[4-(2-methylcyclobutyl)piperazin-1-yl]-2-oxoethyl]piperidin-4-yl]benzamide
SMILESCC1CCC1N1CCN(C(=O)CN2CCC(NC(=O)c3ccccc3)CC2)CC1
InChIInChI=1S/C23H34N4O2/c1-18-7-8-21(18)26-13-15-27(16-14-26)22(28)17-25-11-9-20(10-12-25)24-23(29)19-5-3-2-4-6-19/h2-6,18,20-21H,7-17H2,1H3,(H,24,29)
InChIKeyZRWIQEDZTPTPEV-UHFFFAOYSA-N
MW398.55 g/mol
LogP1.82
Rot. Bonds5

About N-[1-[2-[4-(2-methylcyclobutyl)piperazin-1-yl]-2-oxoethyl]piperidin-4-yl]benzamide

N-[1-[2-[4-(2-methylcyclobutyl)piperazin-1-yl]-2-oxoethyl]piperidin-4-yl]benzamide (PubChem CID 143404085) has the molecular formula C23H34N4O2 and a molecular weight of 398.55 g/mol. Its IUPAC name is N-[1-[2-[4-(2-methylcyclobutyl)piperazin-1-yl]-2-oxoethyl]piperidin-4-yl]benzamide.

Molecular Properties

Compound NameN-[1-[2-[4-(2-methylcyclobutyl)piperazin-1-yl]-2-oxoethyl]piperidin-4-yl]benzamide
PubChem CID143404085
Molecular FormulaC23H34N4O2
Molecular Weight398.55 g/mol
Exact Mass398.27
IUPAC NameN-[1-[2-[4-(2-methylcyclobutyl)piperazin-1-yl]-2-oxoethyl]piperidin-4-yl]benzamide
SMILESCC1CCC1N1CCN(C(=O)CN2CCC(NC(=O)c3ccccc3)CC2)CC1
InChIInChI=1S/C23H34N4O2/c1-18-7-8-21(18)26-13-15-27(16-14-26)22(28)17-25-11-9-20(10-12-25)24-23(29)19-5-3-2-4-6-19/h2-6,18,20-21H,7-17H2,1H3,(H,24,29)
InChIKeyZRWIQEDZTPTPEV-UHFFFAOYSA-N
XLogP1.82
TPSA55.89 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.55
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]piperidin-4-yl]benzamide
CID 33104690
N-[1-[2-(2-oxo-1-pyridinyl)acetyl]piperidin-4-yl]benzamide
CID 24645620
N-[1-[2-(methylamino)acetyl]piperidin-4-yl]benzamide
CID 119698218
N-[(1-phenacylpiperidin-4-yl)carbamoyl]benzamide
CID 12608588
N-[2-(4-benzamidopiperidin-1-yl)-2-oxoethyl]benzamide
CID 34423890
N-[1-[2-oxo-2-(pentan-2-ylamino)ethyl]piperidin-4-yl]benzamide
CID 18131571
ethane;N-(1-methylpiperidin-4-yl)benzamide
CID 142009687
N-[1-(4-methylpiperazine-1-carbonyl)piperidin-4-yl]benzamide
CID 11674340
N-[1-[(4-methylphenyl)methyl]piperidin-4-yl]benzamide
CID 2729497
N-[4-(4-benzamidopiperidin-1-yl)-4-oxobutyl]benzamide
CID 34423868
N-[1-[2-(4-cyclobutylpiperazin-1-yl)-2-oxoethyl]pyrrolidin-3-yl]-4-methylsulfanylbenzamide
CID 57443212
ethyl 4-benzamidopiperidine-1-carboxylate
CID 18120666

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-[4-(2-methylcyclobutyl)piperazin-1-yl]-2-oxoethyl]piperidin-4-yl]benzamide?
The IUPAC name of N-[1-[2-[4-(2-methylcyclobutyl)piperazin-1-yl]-2-oxoethyl]piperidin-4-yl]benzamide (CID 143404085) is N-[1-[2-[4-(2-methylcyclobutyl)piperazin-1-yl]-2-oxoethyl]piperidin-4-yl]benzamide.
What is the SMILES notation for N-[1-[2-[4-(2-methylcyclobutyl)piperazin-1-yl]-2-oxoethyl]piperidin-4-yl]benzamide?
The canonical SMILES for N-[1-[2-[4-(2-methylcyclobutyl)piperazin-1-yl]-2-oxoethyl]piperidin-4-yl]benzamide is CC1CCC1N1CCN(C(=O)CN2CCC(NC(=O)c3ccccc3)CC2)CC1.
What is the InChIKey of N-[1-[2-[4-(2-methylcyclobutyl)piperazin-1-yl]-2-oxoethyl]piperidin-4-yl]benzamide?
The InChIKey is ZRWIQEDZTPTPEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H34N4O2/c1-18-7-8-21(18)26-13-15-27(16-14-26)22(28)17-25-11-9-20(10-12-25)24-23(29)19-5-3-2-4-6-19/h2-6,18,20-21H,7-17H2,1H3,(H,24,29).
What are the key properties of N-[1-[2-[4-(2-methylcyclobutyl)piperazin-1-yl]-2-oxoethyl]piperidin-4-yl]benzamide?
N-[1-[2-[4-(2-methylcyclobutyl)piperazin-1-yl]-2-oxoethyl]piperidin-4-yl]benzamide has a molecular weight of 398.55 g/mol, XLogP of 1.82, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-[4-(2-methylcyclobutyl)piperazin-1-yl]-2-oxoethyl]piperidin-4-yl]benzamide is sourced from PubChem (CID 143404085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).