N-(cyclohexylcarbamoyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]acetamide

C17H28N4O3 — CID 17412205

IUPACN-(cyclohexylcarbamoyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]acetamide
SMILESO=C(CN1CCN(C(=O)C2CC2)CC1)NC(=O)NC1CCCCC1
InChIInChI=1S/C17H28N4O3/c22-15(19-17(24)18-14-4-2-1-3-5-14)12-20-8-10-21(11-9-20)16(23)13-6-7-13/h13-14H,1-12H2,(H2,18,19,22,24)
InChIKeyYDRBQHSPNXKFMS-UHFFFAOYSA-N
MW336.44 g/mol
LogP0.70
Rot. Bonds4

About N-(cyclohexylcarbamoyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]acetamide

N-(cyclohexylcarbamoyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]acetamide (PubChem CID 17412205) has the molecular formula C17H28N4O3 and a molecular weight of 336.44 g/mol. Its IUPAC name is N-(cyclohexylcarbamoyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-(cyclohexylcarbamoyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]acetamide
PubChem CID17412205
Molecular FormulaC17H28N4O3
Molecular Weight336.44 g/mol
Exact Mass336.22
IUPAC NameN-(cyclohexylcarbamoyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]acetamide
SMILESO=C(CN1CCN(C(=O)C2CC2)CC1)NC(=O)NC1CCCCC1
InChIInChI=1S/C17H28N4O3/c22-15(19-17(24)18-14-4-2-1-3-5-14)12-20-8-10-21(11-9-20)16(23)13-6-7-13/h13-14H,1-12H2,(H2,18,19,22,24)
InChIKeyYDRBQHSPNXKFMS-UHFFFAOYSA-N
XLogP0.70
TPSA81.75 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(cyclohexylcarbamoyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylcarbamoyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]acetamide?
The IUPAC name of N-(cyclohexylcarbamoyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]acetamide (CID 17412205) is N-(cyclohexylcarbamoyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-(cyclohexylcarbamoyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]acetamide?
The canonical SMILES for N-(cyclohexylcarbamoyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]acetamide is O=C(CN1CCN(C(=O)C2CC2)CC1)NC(=O)NC1CCCCC1.
What is the InChIKey of N-(cyclohexylcarbamoyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]acetamide?
The InChIKey is YDRBQHSPNXKFMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N4O3/c22-15(19-17(24)18-14-4-2-1-3-5-14)12-20-8-10-21(11-9-20)16(23)13-6-7-13/h13-14H,1-12H2,(H2,18,19,22,24).
What are the key properties of N-(cyclohexylcarbamoyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]acetamide?
N-(cyclohexylcarbamoyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]acetamide has a molecular weight of 336.44 g/mol, XLogP of 0.70, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylcarbamoyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 17412205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).