2-(2,5-dimethylpiperazin-1-yl)-N-(4-methylcyclohexyl)acetamide

C15H29N3O — CID 64980306

IUPAC2-(2,5-dimethylpiperazin-1-yl)-N-(4-methylcyclohexyl)acetamide
SMILESCC1CCC(NC(=O)CN2CC(C)NCC2C)CC1
InChIInChI=1S/C15H29N3O/c1-11-4-6-14(7-5-11)17-15(19)10-18-9-12(2)16-8-13(18)3/h11-14,16H,4-10H2,1-3H3,(H,17,19)
InChIKeyCSMULZSJJCFIBK-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.36
Rot. Bonds3

About 2-(2,5-dimethylpiperazin-1-yl)-N-(4-methylcyclohexyl)acetamide

2-(2,5-dimethylpiperazin-1-yl)-N-(4-methylcyclohexyl)acetamide (PubChem CID 64980306) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 2-(2,5-dimethylpiperazin-1-yl)-N-(4-methylcyclohexyl)acetamide.

Molecular Properties

Compound Name2-(2,5-dimethylpiperazin-1-yl)-N-(4-methylcyclohexyl)acetamide
PubChem CID64980306
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name2-(2,5-dimethylpiperazin-1-yl)-N-(4-methylcyclohexyl)acetamide
SMILESCC1CCC(NC(=O)CN2CC(C)NCC2C)CC1
InChIInChI=1S/C15H29N3O/c1-11-4-6-14(7-5-11)17-15(19)10-18-9-12(2)16-8-13(18)3/h11-14,16H,4-10H2,1-3H3,(H,17,19)
InChIKeyCSMULZSJJCFIBK-UHFFFAOYSA-N
XLogP1.36
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methylcyclohexyl)-2-[(3R)-3-methylpiperazin-1-yl]acetamide
CID 104975687
2-(2,5-dimethylpiperazin-1-yl)-N-propan-2-ylacetamide
CID 64980506
N-(2-acetamidoethyl)-2-(2,5-dimethylpiperazin-1-yl)acetamide
CID 64980464
2-(2,5-dimethylpiperazin-1-yl)-1-(3,5-dimethylpiperidin-1-yl)ethanone
CID 64980735
N-(4-bromophenyl)-2-(2,5-dimethylpiperazin-1-yl)acetamide
CID 64980676
N-cyclopropyl-2-[4-[2-(cyclopropylamino)-2-oxoethyl]-3-methylpiperazin-1-yl]acetamide
CID 78860681
2-[2-(hydroxymethyl)-3-methylpyrrolidin-1-yl]-N-(4-methylcyclohexyl)acetamide
CID 102788580
2-(2,5-dimethylpiperazin-1-yl)-N-ethyl-N-methylacetamide
CID 64980824
N-(4-methylcyclohexyl)-2-(propylamino)acetamide
CID 60671942
N-cyclopropyl-2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]acetamide
CID 27444185
N-cycloheptyl-2-(2-methylpiperazin-1-yl)acetamide;hydrochloride
CID 119916512
3-(2,5-dimethylpiperazin-1-yl)-N-propan-2-ylpropanamide
CID 64980409

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylpiperazin-1-yl)-N-(4-methylcyclohexyl)acetamide?
The IUPAC name of 2-(2,5-dimethylpiperazin-1-yl)-N-(4-methylcyclohexyl)acetamide (CID 64980306) is 2-(2,5-dimethylpiperazin-1-yl)-N-(4-methylcyclohexyl)acetamide.
What is the SMILES notation for 2-(2,5-dimethylpiperazin-1-yl)-N-(4-methylcyclohexyl)acetamide?
The canonical SMILES for 2-(2,5-dimethylpiperazin-1-yl)-N-(4-methylcyclohexyl)acetamide is CC1CCC(NC(=O)CN2CC(C)NCC2C)CC1.
What is the InChIKey of 2-(2,5-dimethylpiperazin-1-yl)-N-(4-methylcyclohexyl)acetamide?
The InChIKey is CSMULZSJJCFIBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-11-4-6-14(7-5-11)17-15(19)10-18-9-12(2)16-8-13(18)3/h11-14,16H,4-10H2,1-3H3,(H,17,19).
What are the key properties of 2-(2,5-dimethylpiperazin-1-yl)-N-(4-methylcyclohexyl)acetamide?
2-(2,5-dimethylpiperazin-1-yl)-N-(4-methylcyclohexyl)acetamide has a molecular weight of 267.42 g/mol, XLogP of 1.36, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylpiperazin-1-yl)-N-(4-methylcyclohexyl)acetamide is sourced from PubChem (CID 64980306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).