N-(2-cyclohexylethyl)-2-(4-methylpiperazin-2-yl)acetamide

C15H29N3O — CID 115178336

IUPACN-(2-cyclohexylethyl)-2-(4-methylpiperazin-2-yl)acetamide
SMILESCN1CCNC(CC(=O)NCCC2CCCCC2)C1
InChIInChI=1S/C15H29N3O/c1-18-10-9-16-14(12-18)11-15(19)17-8-7-13-5-3-2-4-6-13/h13-14,16H,2-12H2,1H3,(H,17,19)
InChIKeyCCYQSOZBKADBNB-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.37
Rot. Bonds5

About N-(2-cyclohexylethyl)-2-(4-methylpiperazin-2-yl)acetamide

N-(2-cyclohexylethyl)-2-(4-methylpiperazin-2-yl)acetamide (PubChem CID 115178336) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is N-(2-cyclohexylethyl)-2-(4-methylpiperazin-2-yl)acetamide.

Molecular Properties

Compound NameN-(2-cyclohexylethyl)-2-(4-methylpiperazin-2-yl)acetamide
PubChem CID115178336
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC NameN-(2-cyclohexylethyl)-2-(4-methylpiperazin-2-yl)acetamide
SMILESCN1CCNC(CC(=O)NCCC2CCCCC2)C1
InChIInChI=1S/C15H29N3O/c1-18-10-9-16-14(12-18)11-15(19)17-8-7-13-5-3-2-4-6-13/h13-14,16H,2-12H2,1H3,(H,17,19)
InChIKeyCCYQSOZBKADBNB-UHFFFAOYSA-N
XLogP1.37
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methylpiperazin-2-yl)-N-[2-(oxan-4-yl)ethyl]acetamide
CID 115178337
N-(3,3-dimethylbutyl)-2-(4-methylpiperazin-2-yl)acetamide
CID 115178327
N-(2-cyclohexylethyl)-2-piperidin-2-ylacetamide
CID 54932758
N-[2-(1-methylpiperidin-4-yl)ethyl]-2-pyrrolidin-2-ylacetamide
CID 113267487
N-(2-cyclohexylethyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119725744
N-[2-(1-methylpiperidin-4-yl)ethyl]-2-thiomorpholin-3-ylacetamide;dihydrochloride
CID 119941640
2-(4-methylpiperazin-2-yl)-N-(1-methylpiperidin-4-yl)acetamide
CID 115178258
N-(cyclohexylmethyl)-N-methyl-2-(4-methylpiperazin-2-yl)acetamide
CID 115178322
tert-butyl N-[2-(4-methylpiperazin-2-yl)ethyl]carbamate
CID 82386141
N-(2-cyclohexylethyl)-3-piperidin-2-ylpropanamide
CID 62210016
2-pyrrolidin-2-yl-N-[2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]acetamide
CID 119898449
2-cyclohexyl-N-methyl-N-[(4-methylpiperazin-2-yl)methyl]ethanamine
CID 115238803

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylethyl)-2-(4-methylpiperazin-2-yl)acetamide?
The IUPAC name of N-(2-cyclohexylethyl)-2-(4-methylpiperazin-2-yl)acetamide (CID 115178336) is N-(2-cyclohexylethyl)-2-(4-methylpiperazin-2-yl)acetamide.
What is the SMILES notation for N-(2-cyclohexylethyl)-2-(4-methylpiperazin-2-yl)acetamide?
The canonical SMILES for N-(2-cyclohexylethyl)-2-(4-methylpiperazin-2-yl)acetamide is CN1CCNC(CC(=O)NCCC2CCCCC2)C1.
What is the InChIKey of N-(2-cyclohexylethyl)-2-(4-methylpiperazin-2-yl)acetamide?
The InChIKey is CCYQSOZBKADBNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-18-10-9-16-14(12-18)11-15(19)17-8-7-13-5-3-2-4-6-13/h13-14,16H,2-12H2,1H3,(H,17,19).
What are the key properties of N-(2-cyclohexylethyl)-2-(4-methylpiperazin-2-yl)acetamide?
N-(2-cyclohexylethyl)-2-(4-methylpiperazin-2-yl)acetamide has a molecular weight of 267.42 g/mol, XLogP of 1.37, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylethyl)-2-(4-methylpiperazin-2-yl)acetamide is sourced from PubChem (CID 115178336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).