1-ethyl-4-[2-[4-(2-propan-2-yloxyethyl)piperidin-1-yl]ethyl]piperazine

C18H37N3O — CID 170364246

IUPAC1-ethyl-4-[2-[4-(2-propan-2-yloxyethyl)piperidin-1-yl]ethyl]piperazine
SMILESCCN1CCN(CCN2CCC(CCOC(C)C)CC2)CC1
InChIInChI=1S/C18H37N3O/c1-4-19-10-12-21(13-11-19)15-14-20-8-5-18(6-9-20)7-16-22-17(2)3/h17-18H,4-16H2,1-3H3
InChIKeyXAWCQTRORVJPRX-UHFFFAOYSA-N
MW311.51 g/mol
LogP2.15
Rot. Bonds8

About 1-ethyl-4-[2-[4-(2-propan-2-yloxyethyl)piperidin-1-yl]ethyl]piperazine

1-ethyl-4-[2-[4-(2-propan-2-yloxyethyl)piperidin-1-yl]ethyl]piperazine (PubChem CID 170364246) has the molecular formula C18H37N3O and a molecular weight of 311.51 g/mol. Its IUPAC name is 1-ethyl-4-[2-[4-(2-propan-2-yloxyethyl)piperidin-1-yl]ethyl]piperazine.

Molecular Properties

Compound Name1-ethyl-4-[2-[4-(2-propan-2-yloxyethyl)piperidin-1-yl]ethyl]piperazine
PubChem CID170364246
Molecular FormulaC18H37N3O
Molecular Weight311.51 g/mol
Exact Mass311.29
IUPAC Name1-ethyl-4-[2-[4-(2-propan-2-yloxyethyl)piperidin-1-yl]ethyl]piperazine
SMILESCCN1CCN(CCN2CCC(CCOC(C)C)CC2)CC1
InChIInChI=1S/C18H37N3O/c1-4-19-10-12-21(13-11-19)15-14-20-8-5-18(6-9-20)7-16-22-17(2)3/h17-18H,4-16H2,1-3H3
InChIKeyXAWCQTRORVJPRX-UHFFFAOYSA-N
XLogP2.15
TPSA18.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.51
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-ethyl-4-[2-[4-(2-propan-2-yloxyethyl)piperidin-1-yl]ethyl]piperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-methylpentyl)-4-(3-propan-2-yloxypropyl)piperidine
CID 170372323
4-(bromomethyl)-1-(2-propan-2-yloxyethyl)piperidine
CID 80677013
[1-(2-propan-2-yloxyethyl)piperidin-4-yl]methanamine
CID 61485123
1-[3-(1-ethylpiperidin-4-yl)propyl]-4-(2-methylpropyl)piperazine
CID 156885442
1-[2-[4-(3-methoxypropyl)piperidin-1-yl]ethyl]-4-propan-2-ylpiperidine
CID 175629532
1-ethyl-4-[2-(4-propan-2-ylpiperidin-1-yl)ethoxymethyl]piperidine
CID 176983279
1-(4-methylpentyl)-4-[2-(5-propan-2-yloxypentoxy)ethyl]piperidine
CID 154992758
1-(2-cyclopropylethyl)-4-ethylpiperazine
CID 171795940
1-(4-methylpiperazin-1-yl)-2-[4-(2-propan-2-yloxyethyl)piperidin-1-yl]ethanone
CID 170569122
2-propan-2-yloxyethylcycloheptane
CID 123201160
ethane;N-[2-[4-[(4-ethylpiperazin-1-yl)methyl]piperidin-1-yl]ethyl]-N-methylpropan-2-amine;1-(2-propan-2-yloxyethyl)-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperazine
CID 177203726
N-[[1-(2-propan-2-yloxyethyl)piperidin-4-yl]methyl]propan-1-amine
CID 62592739

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-[2-[4-(2-propan-2-yloxyethyl)piperidin-1-yl]ethyl]piperazine?
The IUPAC name of 1-ethyl-4-[2-[4-(2-propan-2-yloxyethyl)piperidin-1-yl]ethyl]piperazine (CID 170364246) is 1-ethyl-4-[2-[4-(2-propan-2-yloxyethyl)piperidin-1-yl]ethyl]piperazine.
What is the SMILES notation for 1-ethyl-4-[2-[4-(2-propan-2-yloxyethyl)piperidin-1-yl]ethyl]piperazine?
The canonical SMILES for 1-ethyl-4-[2-[4-(2-propan-2-yloxyethyl)piperidin-1-yl]ethyl]piperazine is CCN1CCN(CCN2CCC(CCOC(C)C)CC2)CC1.
What is the InChIKey of 1-ethyl-4-[2-[4-(2-propan-2-yloxyethyl)piperidin-1-yl]ethyl]piperazine?
The InChIKey is XAWCQTRORVJPRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37N3O/c1-4-19-10-12-21(13-11-19)15-14-20-8-5-18(6-9-20)7-16-22-17(2)3/h17-18H,4-16H2,1-3H3.
What are the key properties of 1-ethyl-4-[2-[4-(2-propan-2-yloxyethyl)piperidin-1-yl]ethyl]piperazine?
1-ethyl-4-[2-[4-(2-propan-2-yloxyethyl)piperidin-1-yl]ethyl]piperazine has a molecular weight of 311.51 g/mol, XLogP of 2.15, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-[2-[4-(2-propan-2-yloxyethyl)piperidin-1-yl]ethyl]piperazine is sourced from PubChem (CID 170364246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).