(2R)-4-(cyclopentylmethyl)-1-(2-ethoxyethyl)-2-methylpiperazine

C15H30N2O — CID 124778699

IUPAC(2R)-4-(cyclopentylmethyl)-1-(2-ethoxyethyl)-2-methylpiperazine
SMILESCCOCCN1CCN(CC2CCCC2)C[C@H]1C
InChIInChI=1S/C15H30N2O/c1-3-18-11-10-17-9-8-16(12-14(17)2)13-15-6-4-5-7-15/h14-15H,3-13H2,1-2H3/t14-/m1/s1
InChIKeyHSDORHJHTXJMLZ-CQSZACIVSA-N
MW254.42 g/mol
LogP2.22
Rot. Bonds6

About (2R)-4-(cyclopentylmethyl)-1-(2-ethoxyethyl)-2-methylpiperazine

(2R)-4-(cyclopentylmethyl)-1-(2-ethoxyethyl)-2-methylpiperazine (PubChem CID 124778699) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is (2R)-4-(cyclopentylmethyl)-1-(2-ethoxyethyl)-2-methylpiperazine.

Molecular Properties

Compound Name(2R)-4-(cyclopentylmethyl)-1-(2-ethoxyethyl)-2-methylpiperazine
PubChem CID124778699
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name(2R)-4-(cyclopentylmethyl)-1-(2-ethoxyethyl)-2-methylpiperazine
SMILESCCOCCN1CCN(CC2CCCC2)C[C@H]1C
InChIInChI=1S/C15H30N2O/c1-3-18-11-10-17-9-8-16(12-14(17)2)13-15-6-4-5-7-15/h14-15H,3-13H2,1-2H3/t14-/m1/s1
InChIKeyHSDORHJHTXJMLZ-CQSZACIVSA-N
XLogP2.22
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(2R)-1-(2-ethoxyethyl)-2-methyl-4-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]piperazine
CID 124826688
(2S)-1-[(3S)-4-(2-ethoxyethyl)-3-methylpiperazin-1-yl]-3-(4-methylpiperidin-1-yl)propan-2-ol
CID 100842222
1-(2-ethoxyethyl)-2-methylpyrrolidine
CID 175912703
1-[3-[(3R)-4-(2-ethoxyethyl)-3-methylpiperazin-1-yl]propyl]pyrrolidin-2-one
CID 124736823
ethane;(2S)-1-ethyl-2-methyl-4-[(1-methylpiperidin-4-yl)methyl]piperazine
CID 165138024
3-[(3S)-4-(2-ethoxyethyl)-3-methylpiperazin-1-yl]-N,N-dimethylpropane-1-sulfonamide
CID 95347534
(1R)-2-[(3S)-4-(2-ethoxyethyl)-3-methylpiperazin-1-yl]-1-(4-propan-2-ylphenyl)ethanol
CID 95978212
3-[2-[(3R)-4-(2-ethoxyethyl)-3-methylpiperazin-1-yl]ethyl]imidazolidine-2,4-dione
CID 124780397
2-[(3R)-4-(2-ethoxyethyl)-3-methylpiperazin-1-yl]-N-[(3R)-2-oxoazepan-3-yl]acetamide
CID 124840360
(2R)-1-(2-ethoxyethyl)-4-[2-(4-methoxyphenyl)ethyl]-2-methylpiperazine
CID 124737287
3-ethoxy-N-[2-(4-ethyl-3-methylpiperazin-1-yl)ethyl]propan-1-amine
CID 63619832
(2R)-1-(2-methoxyethyl)-2-methyl-4-[2-[2-[1-[(1-methylpiperidin-4-yl)methyl]piperidin-4-yl]oxyethoxy]ethyl]piperazine
CID 168903099

Frequently Asked Questions

What is the IUPAC name of (2R)-4-(cyclopentylmethyl)-1-(2-ethoxyethyl)-2-methylpiperazine?
The IUPAC name of (2R)-4-(cyclopentylmethyl)-1-(2-ethoxyethyl)-2-methylpiperazine (CID 124778699) is (2R)-4-(cyclopentylmethyl)-1-(2-ethoxyethyl)-2-methylpiperazine.
What is the SMILES notation for (2R)-4-(cyclopentylmethyl)-1-(2-ethoxyethyl)-2-methylpiperazine?
The canonical SMILES for (2R)-4-(cyclopentylmethyl)-1-(2-ethoxyethyl)-2-methylpiperazine is CCOCCN1CCN(CC2CCCC2)C[C@H]1C.
What is the InChIKey of (2R)-4-(cyclopentylmethyl)-1-(2-ethoxyethyl)-2-methylpiperazine?
The InChIKey is HSDORHJHTXJMLZ-CQSZACIVSA-N. The full InChI is InChI=1S/C15H30N2O/c1-3-18-11-10-17-9-8-16(12-14(17)2)13-15-6-4-5-7-15/h14-15H,3-13H2,1-2H3/t14-/m1/s1.
What are the key properties of (2R)-4-(cyclopentylmethyl)-1-(2-ethoxyethyl)-2-methylpiperazine?
(2R)-4-(cyclopentylmethyl)-1-(2-ethoxyethyl)-2-methylpiperazine has a molecular weight of 254.42 g/mol, XLogP of 2.22, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-(cyclopentylmethyl)-1-(2-ethoxyethyl)-2-methylpiperazine is sourced from PubChem (CID 124778699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).