N-(2-methylpropylcarbamoyl)-2-[4-(2-phenylethyl)piperazin-1-yl]acetamide

C19H30N4O2 — CID 34943993

IUPACN-(2-methylpropylcarbamoyl)-2-[4-(2-phenylethyl)piperazin-1-yl]acetamide
SMILESCC(C)CNC(=O)NC(=O)CN1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C19H30N4O2/c1-16(2)14-20-19(25)21-18(24)15-23-12-10-22(11-13-23)9-8-17-6-4-3-5-7-17/h3-7,16H,8-15H2,1-2H3,(H2,20,21,24,25)
InChIKeyWWVMXIMBHWKWEJ-UHFFFAOYSA-N
MW346.48 g/mol
LogP1.33
Rot. Bonds7

About N-(2-methylpropylcarbamoyl)-2-[4-(2-phenylethyl)piperazin-1-yl]acetamide

N-(2-methylpropylcarbamoyl)-2-[4-(2-phenylethyl)piperazin-1-yl]acetamide (PubChem CID 34943993) has the molecular formula C19H30N4O2 and a molecular weight of 346.48 g/mol. Its IUPAC name is N-(2-methylpropylcarbamoyl)-2-[4-(2-phenylethyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-methylpropylcarbamoyl)-2-[4-(2-phenylethyl)piperazin-1-yl]acetamide
PubChem CID34943993
Molecular FormulaC19H30N4O2
Molecular Weight346.48 g/mol
Exact Mass346.24
IUPAC NameN-(2-methylpropylcarbamoyl)-2-[4-(2-phenylethyl)piperazin-1-yl]acetamide
SMILESCC(C)CNC(=O)NC(=O)CN1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C19H30N4O2/c1-16(2)14-20-19(25)21-18(24)15-23-12-10-22(11-13-23)9-8-17-6-4-3-5-7-17/h3-7,16H,8-15H2,1-2H3,(H2,20,21,24,25)
InChIKeyWWVMXIMBHWKWEJ-UHFFFAOYSA-N
XLogP1.33
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.48
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-phenylethyl)-2-[4-(2-phenylethyl)piperazin-1-yl]acetamide
CID 18125323
N-[(4-methylphenyl)methyl]-2-[4-(2-phenylethyl)piperazin-1-yl]acetamide
CID 34943408
2-[4-(4-fluorophenyl)piperazin-1-yl]-N-(2-methylpropylcarbamoyl)acetamide
CID 8703887
2-[4-[2-(2,2-diphenylethylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-methylpropyl)acetamide
CID 30737553
2-benzylsulfanyl-N-(2-methylpropylcarbamoyl)acetamide
CID 2647854
3-[4-[2-(2-methylpropylamino)-2-oxoethyl]piperazin-1-yl]-N-(1-phenylethyl)propanamide
CID 24589378
N-[1-(2,4-dichlorophenyl)ethyl]-2-[4-(2-phenylethyl)piperazin-1-yl]acetamide
CID 55470483
2-(2,3-dihydroindol-1-yl)-N-(2-methylpropylcarbamoyl)acetamide
CID 8704309
methyl 4-(2-phenylethyl)piperazine-1-carboxylate
CID 1246166
2-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-N-(2-methylpropylcarbamoyl)acetamide
CID 8757875
2-[4-(5-bromo-2-pyridinyl)piperazin-1-yl]-N-(2-methylpropylcarbamoyl)acetamide
CID 37407100
N-[[3-(methoxymethyl)phenyl]methyl]-2-[4-(2-phenylethyl)piperazin-1-yl]acetamide
CID 87015230

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropylcarbamoyl)-2-[4-(2-phenylethyl)piperazin-1-yl]acetamide?
The IUPAC name of N-(2-methylpropylcarbamoyl)-2-[4-(2-phenylethyl)piperazin-1-yl]acetamide (CID 34943993) is N-(2-methylpropylcarbamoyl)-2-[4-(2-phenylethyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-(2-methylpropylcarbamoyl)-2-[4-(2-phenylethyl)piperazin-1-yl]acetamide?
The canonical SMILES for N-(2-methylpropylcarbamoyl)-2-[4-(2-phenylethyl)piperazin-1-yl]acetamide is CC(C)CNC(=O)NC(=O)CN1CCN(CCc2ccccc2)CC1.
What is the InChIKey of N-(2-methylpropylcarbamoyl)-2-[4-(2-phenylethyl)piperazin-1-yl]acetamide?
The InChIKey is WWVMXIMBHWKWEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N4O2/c1-16(2)14-20-19(25)21-18(24)15-23-12-10-22(11-13-23)9-8-17-6-4-3-5-7-17/h3-7,16H,8-15H2,1-2H3,(H2,20,21,24,25).
What are the key properties of N-(2-methylpropylcarbamoyl)-2-[4-(2-phenylethyl)piperazin-1-yl]acetamide?
N-(2-methylpropylcarbamoyl)-2-[4-(2-phenylethyl)piperazin-1-yl]acetamide has a molecular weight of 346.48 g/mol, XLogP of 1.33, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropylcarbamoyl)-2-[4-(2-phenylethyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 34943993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).