N-cyclopropyl-3-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]propanamide

C19H27N3O2 — CID 51103973

IUPACN-cyclopropyl-3-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]propanamide
SMILESCc1ccccc1CC(=O)N1CCN(CCC(=O)NC2CC2)CC1
InChIInChI=1S/C19H27N3O2/c1-15-4-2-3-5-16(15)14-19(24)22-12-10-21(11-13-22)9-8-18(23)20-17-6-7-17/h2-5,17H,6-14H2,1H3,(H,20,23)
InChIKeyGDHLBGWVBDVCJV-UHFFFAOYSA-N
MW329.44 g/mol
LogP1.35
Rot. Bonds6

About N-cyclopropyl-3-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]propanamide

N-cyclopropyl-3-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]propanamide (PubChem CID 51103973) has the molecular formula C19H27N3O2 and a molecular weight of 329.44 g/mol. Its IUPAC name is N-cyclopropyl-3-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]propanamide
PubChem CID51103973
Molecular FormulaC19H27N3O2
Molecular Weight329.44 g/mol
Exact Mass329.21
IUPAC NameN-cyclopropyl-3-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]propanamide
SMILESCc1ccccc1CC(=O)N1CCN(CCC(=O)NC2CC2)CC1
InChIInChI=1S/C19H27N3O2/c1-15-4-2-3-5-16(15)14-19(24)22-12-10-21(11-13-22)9-8-18(23)20-17-6-7-17/h2-5,17H,6-14H2,1H3,(H,20,23)
InChIKeyGDHLBGWVBDVCJV-UHFFFAOYSA-N
XLogP1.35
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.44
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cyclopropyl-3-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]propanamide with MolForge

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Related Compounds

N-[(1R)-1-cyclopropylethyl]-2-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]acetamide
CID 95383065
[1-[2-(2-methylphenyl)acetyl]piperidin-4-yl]urea
CID 71985156
2-(2-methylphenyl)-1-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]ethanone
CID 113073706
N-cyclopropyl-3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanamide
CID 34207696
2-(2-methylphenyl)-1-[4-(2-phenylethyl)piperazin-1-yl]ethanone
CID 17145715
N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]-4-morpholin-4-yl-4-oxobutanamide
CID 136577829
ethyl 4-[3-(cyclopropylamino)-3-oxopropyl]piperazine-1-carboxylate
CID 51077572
3-cyclopentyl-1-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]propan-1-one
CID 134021008
3-(4-ethylpiperazin-1-yl)-N-[(2-methylphenyl)methyl]propanamide
CID 109017626
3-amino-1-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]propan-1-one;hydrochloride
CID 119311717
N-cyclopentyl-4-[4-[(3-methyl-2-pyridinyl)methyl]piperazin-1-yl]-4-oxobutanamide
CID 46989818
1-(4-cyclopentylpiperazin-1-yl)-2-(2-methylphenyl)ethanone
CID 110708909

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]propanamide?
The IUPAC name of N-cyclopropyl-3-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]propanamide (CID 51103973) is N-cyclopropyl-3-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]propanamide.
What is the SMILES notation for N-cyclopropyl-3-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]propanamide?
The canonical SMILES for N-cyclopropyl-3-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]propanamide is Cc1ccccc1CC(=O)N1CCN(CCC(=O)NC2CC2)CC1.
What is the InChIKey of N-cyclopropyl-3-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]propanamide?
The InChIKey is GDHLBGWVBDVCJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O2/c1-15-4-2-3-5-16(15)14-19(24)22-12-10-21(11-13-22)9-8-18(23)20-17-6-7-17/h2-5,17H,6-14H2,1H3,(H,20,23).
What are the key properties of N-cyclopropyl-3-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]propanamide?
N-cyclopropyl-3-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]propanamide has a molecular weight of 329.44 g/mol, XLogP of 1.35, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]propanamide is sourced from PubChem (CID 51103973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).