4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(2-piperidin-1-ylpropyl)benzamide

C23H34N4O2 — CID 110620588

IUPAC4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(2-piperidin-1-ylpropyl)benzamide
SMILESCC(CNC(=O)c1ccc(N2CCN(C(=O)C3CC3)CC2)cc1)N1CCCCC1
InChIInChI=1S/C23H34N4O2/c1-18(25-11-3-2-4-12-25)17-24-22(28)19-7-9-21(10-8-19)26-13-15-27(16-14-26)23(29)20-5-6-20/h7-10,18,20H,2-6,11-17H2,1H3,(H,24,28)
InChIKeyCHIPPJWRDMXURV-UHFFFAOYSA-N
MW398.55 g/mol
LogP2.35
Rot. Bonds6

About 4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(2-piperidin-1-ylpropyl)benzamide

4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(2-piperidin-1-ylpropyl)benzamide (PubChem CID 110620588) has the molecular formula C23H34N4O2 and a molecular weight of 398.55 g/mol. Its IUPAC name is 4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(2-piperidin-1-ylpropyl)benzamide.

Molecular Properties

Compound Name4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(2-piperidin-1-ylpropyl)benzamide
PubChem CID110620588
Molecular FormulaC23H34N4O2
Molecular Weight398.55 g/mol
Exact Mass398.27
IUPAC Name4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(2-piperidin-1-ylpropyl)benzamide
SMILESCC(CNC(=O)c1ccc(N2CCN(C(=O)C3CC3)CC2)cc1)N1CCCCC1
InChIInChI=1S/C23H34N4O2/c1-18(25-11-3-2-4-12-25)17-24-22(28)19-7-9-21(10-8-19)26-13-15-27(16-14-26)23(29)20-5-6-20/h7-10,18,20H,2-6,11-17H2,1H3,(H,24,28)
InChIKeyCHIPPJWRDMXURV-UHFFFAOYSA-N
XLogP2.35
TPSA55.89 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.55
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(2-methylpropyl)benzamide
CID 110406768
N-(2-piperidin-1-ylpropyl)-4-pyrrol-1-ylbenzamide
CID 110301675
4-chloro-N-(2-pyrrolidin-1-ylpropyl)benzamide
CID 47187389
4-phenyl-N-[(2S)-2-pyrrolidin-1-ylpropyl]benzamide
CID 93157618
4-phenyl-N-[(2R)-2-pyrrolidin-1-ylpropyl]benzamide
CID 93157619
4-cyano-N-(2-pyrrolidin-1-ylpropyl)benzamide
CID 47026894
4-(3-hydroxy-3-methylbutyl)-N-[(2R)-2-pyrrolidin-1-ylpropyl]benzamide
CID 95860893
cyclobutyl-[4-(4-piperidin-1-ylphenyl)piperazin-1-yl]methanone
CID 113079016
4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(3,4-dimethylphenyl)benzamide
CID 110418111
4-(4-methyl-1,1,3-trioxo-1,2-thiazolidin-2-yl)-N-(2-pyrrolidin-1-ylpropyl)benzamide
CID 110301572
6-methoxy-N-[(2S)-2-piperidin-1-ylpropyl]pyridine-3-carboxamide
CID 94633091
N-[(2R)-2-(azepan-1-yl)propyl]-1-methylpyrazole-4-carboxamide
CID 39554190

Frequently Asked Questions

What is the IUPAC name of 4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(2-piperidin-1-ylpropyl)benzamide?
The IUPAC name of 4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(2-piperidin-1-ylpropyl)benzamide (CID 110620588) is 4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(2-piperidin-1-ylpropyl)benzamide.
What is the SMILES notation for 4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(2-piperidin-1-ylpropyl)benzamide?
The canonical SMILES for 4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(2-piperidin-1-ylpropyl)benzamide is CC(CNC(=O)c1ccc(N2CCN(C(=O)C3CC3)CC2)cc1)N1CCCCC1.
What is the InChIKey of 4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(2-piperidin-1-ylpropyl)benzamide?
The InChIKey is CHIPPJWRDMXURV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H34N4O2/c1-18(25-11-3-2-4-12-25)17-24-22(28)19-7-9-21(10-8-19)26-13-15-27(16-14-26)23(29)20-5-6-20/h7-10,18,20H,2-6,11-17H2,1H3,(H,24,28).
What are the key properties of 4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(2-piperidin-1-ylpropyl)benzamide?
4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(2-piperidin-1-ylpropyl)benzamide has a molecular weight of 398.55 g/mol, XLogP of 2.35, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(2-piperidin-1-ylpropyl)benzamide is sourced from PubChem (CID 110620588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).