2-methyl-N-[(3-methylcyclopentyl)methyl]-2-piperazin-1-ylpropanamide

C15H29N3O — CID 107413127

IUPAC2-methyl-N-[(3-methylcyclopentyl)methyl]-2-piperazin-1-ylpropanamide
SMILESCC1CCC(CNC(=O)C(C)(C)N2CCNCC2)C1
InChIInChI=1S/C15H29N3O/c1-12-4-5-13(10-12)11-17-14(19)15(2,3)18-8-6-16-7-9-18/h12-13,16H,4-11H2,1-3H3,(H,17,19)
InChIKeySZBXYQHNEAIESK-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.22
Rot. Bonds4

About 2-methyl-N-[(3-methylcyclopentyl)methyl]-2-piperazin-1-ylpropanamide

2-methyl-N-[(3-methylcyclopentyl)methyl]-2-piperazin-1-ylpropanamide (PubChem CID 107413127) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 2-methyl-N-[(3-methylcyclopentyl)methyl]-2-piperazin-1-ylpropanamide.

Molecular Properties

Compound Name2-methyl-N-[(3-methylcyclopentyl)methyl]-2-piperazin-1-ylpropanamide
PubChem CID107413127
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name2-methyl-N-[(3-methylcyclopentyl)methyl]-2-piperazin-1-ylpropanamide
SMILESCC1CCC(CNC(=O)C(C)(C)N2CCNCC2)C1
InChIInChI=1S/C15H29N3O/c1-12-4-5-13(10-12)11-17-14(19)15(2,3)18-8-6-16-7-9-18/h12-13,16H,4-11H2,1-3H3,(H,17,19)
InChIKeySZBXYQHNEAIESK-UHFFFAOYSA-N
XLogP1.22
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-hydroxycyclohexyl)methyl]-2-methyl-2-piperazin-1-ylpropanamide
CID 106135108
2-amino-2-methyl-N-[(3-methylcyclopentyl)methyl]propanamide
CID 107413148
2-methyl-N-(3-methylcyclopentyl)-2-piperazin-1-ylpropanamide
CID 114546276
2-(1,4-diazepan-1-yl)-N-[(3-methylcyclopentyl)methyl]-2-oxoacetamide
CID 107414743
N-[[2-(hydroxymethyl)cyclopentyl]methyl]-2-methyl-2-piperazin-1-ylpropanamide
CID 80551292
2,2,2-trifluoro-N-[(3-methylcyclopentyl)methyl]acetamide
CID 107415477
2-methyl-2-piperazin-1-yl-N-propylpropanamide
CID 80548473
2-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]-2-piperazin-1-ylpropanamide
CID 80548101
N-ethyl-2-methyl-2-piperazin-1-ylpropanamide
CID 80548345
N-butyl-2-methyl-2-piperazin-1-ylpropanamide
CID 80548594
N-(3,5-dimethylcyclohexyl)-2-methyl-2-piperazin-1-ylpropanamide
CID 80549992
N-(2,3-dimethylbutyl)-2-methyl-2-piperazin-1-ylpropanamide
CID 80550084

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(3-methylcyclopentyl)methyl]-2-piperazin-1-ylpropanamide?
The IUPAC name of 2-methyl-N-[(3-methylcyclopentyl)methyl]-2-piperazin-1-ylpropanamide (CID 107413127) is 2-methyl-N-[(3-methylcyclopentyl)methyl]-2-piperazin-1-ylpropanamide.
What is the SMILES notation for 2-methyl-N-[(3-methylcyclopentyl)methyl]-2-piperazin-1-ylpropanamide?
The canonical SMILES for 2-methyl-N-[(3-methylcyclopentyl)methyl]-2-piperazin-1-ylpropanamide is CC1CCC(CNC(=O)C(C)(C)N2CCNCC2)C1.
What is the InChIKey of 2-methyl-N-[(3-methylcyclopentyl)methyl]-2-piperazin-1-ylpropanamide?
The InChIKey is SZBXYQHNEAIESK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-12-4-5-13(10-12)11-17-14(19)15(2,3)18-8-6-16-7-9-18/h12-13,16H,4-11H2,1-3H3,(H,17,19).
What are the key properties of 2-methyl-N-[(3-methylcyclopentyl)methyl]-2-piperazin-1-ylpropanamide?
2-methyl-N-[(3-methylcyclopentyl)methyl]-2-piperazin-1-ylpropanamide has a molecular weight of 267.42 g/mol, XLogP of 1.22, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(3-methylcyclopentyl)methyl]-2-piperazin-1-ylpropanamide is sourced from PubChem (CID 107413127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).