2-cyclopentyl-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]propanamide

C15H27N3O2 — CID 110605936

IUPAC2-cyclopentyl-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]propanamide
SMILESCC(C(=O)NCC(=O)N1CCN(C)CC1)C1CCCC1
InChIInChI=1S/C15H27N3O2/c1-12(13-5-3-4-6-13)15(20)16-11-14(19)18-9-7-17(2)8-10-18/h12-13H,3-11H2,1-2H3,(H,16,20)
InChIKeyFHUFCNJSTCZYAU-UHFFFAOYSA-N
MW281.40 g/mol
LogP0.70
Rot. Bonds4

About 2-cyclopentyl-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]propanamide

2-cyclopentyl-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]propanamide (PubChem CID 110605936) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is 2-cyclopentyl-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]propanamide.

Molecular Properties

Compound Name2-cyclopentyl-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]propanamide
PubChem CID110605936
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC Name2-cyclopentyl-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]propanamide
SMILESCC(C(=O)NCC(=O)N1CCN(C)CC1)C1CCCC1
InChIInChI=1S/C15H27N3O2/c1-12(13-5-3-4-6-13)15(20)16-11-14(19)18-9-7-17(2)8-10-18/h12-13H,3-11H2,1-2H3,(H,16,20)
InChIKeyFHUFCNJSTCZYAU-UHFFFAOYSA-N
XLogP0.70
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(4-methylpiperazin-1-yl)-2-oxoethyl]urea
CID 127518835
2-[(2-cyclopropyl-2-hydroxyethyl)amino]-1-(4-methylpiperazin-1-yl)ethanone
CID 63298948
2-(cyclopentylamino)-1-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]ethanone
CID 22321698
N-[2-(cycloheptylamino)ethyl]-2-cyclopropylpropanamide
CID 81482446
N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]cyclopentanesulfonamide
CID 110406941
N-butyl-2-cyclopentylpropanamide
CID 173178636
N-cycloheptyl-3-(4-methylpiperazin-1-yl)-3-oxopropanamide
CID 108944377
N-(2-amino-2-oxoethyl)-2-cyclopropylpropanamide
CID 79505889
2-cyclopentyl-N-[2-(dimethylamino)-2-methylpropyl]propanamide
CID 110353510
2-methylpropyl N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]carbamate
CID 163549649
2-[(2-methylcyclohexyl)methylamino]-1-(4-methylpiperazin-1-yl)ethanone
CID 55013400
3-(1-cyclopropylethylamino)-1-(4-methylpiperazin-1-yl)propan-1-one
CID 119145626

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]propanamide?
The IUPAC name of 2-cyclopentyl-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]propanamide (CID 110605936) is 2-cyclopentyl-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]propanamide.
What is the SMILES notation for 2-cyclopentyl-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]propanamide?
The canonical SMILES for 2-cyclopentyl-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]propanamide is CC(C(=O)NCC(=O)N1CCN(C)CC1)C1CCCC1.
What is the InChIKey of 2-cyclopentyl-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]propanamide?
The InChIKey is FHUFCNJSTCZYAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c1-12(13-5-3-4-6-13)15(20)16-11-14(19)18-9-7-17(2)8-10-18/h12-13H,3-11H2,1-2H3,(H,16,20).
What are the key properties of 2-cyclopentyl-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]propanamide?
2-cyclopentyl-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]propanamide has a molecular weight of 281.40 g/mol, XLogP of 0.70, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]propanamide is sourced from PubChem (CID 110605936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).