N-cyclopropyl-2-[4-(3-propan-2-yloxypropanoyl)piperazin-1-yl]acetamide

C15H27N3O3 — CID 86929481

IUPACN-cyclopropyl-2-[4-(3-propan-2-yloxypropanoyl)piperazin-1-yl]acetamide
SMILESCC(C)OCCC(=O)N1CCN(CC(=O)NC2CC2)CC1
InChIInChI=1S/C15H27N3O3/c1-12(2)21-10-5-15(20)18-8-6-17(7-9-18)11-14(19)16-13-3-4-13/h12-13H,3-11H2,1-2H3,(H,16,19)
InChIKeyXTVSNDMYCYBCNL-UHFFFAOYSA-N
MW297.40 g/mol
LogP0.22
Rot. Bonds7

About N-cyclopropyl-2-[4-(3-propan-2-yloxypropanoyl)piperazin-1-yl]acetamide

N-cyclopropyl-2-[4-(3-propan-2-yloxypropanoyl)piperazin-1-yl]acetamide (PubChem CID 86929481) has the molecular formula C15H27N3O3 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-cyclopropyl-2-[4-(3-propan-2-yloxypropanoyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[4-(3-propan-2-yloxypropanoyl)piperazin-1-yl]acetamide
PubChem CID86929481
Molecular FormulaC15H27N3O3
Molecular Weight297.40 g/mol
Exact Mass297.21
IUPAC NameN-cyclopropyl-2-[4-(3-propan-2-yloxypropanoyl)piperazin-1-yl]acetamide
SMILESCC(C)OCCC(=O)N1CCN(CC(=O)NC2CC2)CC1
InChIInChI=1S/C15H27N3O3/c1-12(2)21-10-5-15(20)18-8-6-17(7-9-18)11-14(19)16-13-3-4-13/h12-13H,3-11H2,1-2H3,(H,16,19)
InChIKeyXTVSNDMYCYBCNL-UHFFFAOYSA-N
XLogP0.22
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-2-(4-pentanoylpiperazin-1-yl)acetamide
CID 110709694
N-cyclopropyl-2-[4-[2-(methylamino)acetyl]piperazin-1-yl]acetamide
CID 120703373
N-cyclopropyl-2-[4-(3-phenoxypropanoyl)piperazin-1-yl]acetamide
CID 110709703
N-cyclopropyl-2-[4-[2-(4-methylpiperidin-1-yl)acetyl]piperazin-1-yl]acetamide
CID 78822225
N-cyclopropyl-2-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]acetamide
CID 110709709
N-cyclopropyl-2-[4-[3-(3,4-dimethylphenoxy)propanoyl]piperazin-1-yl]acetamide
CID 47022937
2-[4-(4-aminobutanoyl)piperazin-1-yl]-N-(4-methylcyclohexyl)acetamide
CID 119876677
N-cyclopropyl-2-[4-[3-(2,3-dimethylphenoxy)propanoyl]piperazin-1-yl]acetamide
CID 47024315
N-(1-methylpiperidin-4-yl)-3-propan-2-yloxypropanamide
CID 142467334
2-[4-(3-ethoxypropanoyl)piperazin-1-yl]-N-[(1R,3S)-3-methylcyclohexyl]acetamide
CID 95172406
1-[4-(1-aminoethyl)piperidin-1-yl]-3-propan-2-yloxypropan-1-one
CID 119517505
N-cyclopropyl-2-[4-[(2S)-2-cyclopropyl-2-hydroxyethyl]piperazin-1-yl]acetamide
CID 97038977

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[4-(3-propan-2-yloxypropanoyl)piperazin-1-yl]acetamide?
The IUPAC name of N-cyclopropyl-2-[4-(3-propan-2-yloxypropanoyl)piperazin-1-yl]acetamide (CID 86929481) is N-cyclopropyl-2-[4-(3-propan-2-yloxypropanoyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[4-(3-propan-2-yloxypropanoyl)piperazin-1-yl]acetamide?
The canonical SMILES for N-cyclopropyl-2-[4-(3-propan-2-yloxypropanoyl)piperazin-1-yl]acetamide is CC(C)OCCC(=O)N1CCN(CC(=O)NC2CC2)CC1.
What is the InChIKey of N-cyclopropyl-2-[4-(3-propan-2-yloxypropanoyl)piperazin-1-yl]acetamide?
The InChIKey is XTVSNDMYCYBCNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O3/c1-12(2)21-10-5-15(20)18-8-6-17(7-9-18)11-14(19)16-13-3-4-13/h12-13H,3-11H2,1-2H3,(H,16,19).
What are the key properties of N-cyclopropyl-2-[4-(3-propan-2-yloxypropanoyl)piperazin-1-yl]acetamide?
N-cyclopropyl-2-[4-(3-propan-2-yloxypropanoyl)piperazin-1-yl]acetamide has a molecular weight of 297.40 g/mol, XLogP of 0.22, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[4-(3-propan-2-yloxypropanoyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 86929481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).