1-(1-ethylpiperidin-4-yl)-4-(pyrrolidin-3-ylmethyl)piperazine

C16H32N4 — CID 170063851

IUPAC1-(1-ethylpiperidin-4-yl)-4-(pyrrolidin-3-ylmethyl)piperazine
SMILESCCN1CCC(N2CCN(CC3CCNC3)CC2)CC1
InChIInChI=1S/C16H32N4/c1-2-18-7-4-16(5-8-18)20-11-9-19(10-12-20)14-15-3-6-17-13-15/h15-17H,2-14H2,1H3
InChIKeyAZDQARCPDBJUHT-UHFFFAOYSA-N
MW280.46 g/mol
LogP0.70
Rot. Bonds4

About 1-(1-ethylpiperidin-4-yl)-4-(pyrrolidin-3-ylmethyl)piperazine

1-(1-ethylpiperidin-4-yl)-4-(pyrrolidin-3-ylmethyl)piperazine (PubChem CID 170063851) has the molecular formula C16H32N4 and a molecular weight of 280.46 g/mol. Its IUPAC name is 1-(1-ethylpiperidin-4-yl)-4-(pyrrolidin-3-ylmethyl)piperazine.

Molecular Properties

Compound Name1-(1-ethylpiperidin-4-yl)-4-(pyrrolidin-3-ylmethyl)piperazine
PubChem CID170063851
Molecular FormulaC16H32N4
Molecular Weight280.46 g/mol
Exact Mass280.26
IUPAC Name1-(1-ethylpiperidin-4-yl)-4-(pyrrolidin-3-ylmethyl)piperazine
SMILESCCN1CCC(N2CCN(CC3CCNC3)CC2)CC1
InChIInChI=1S/C16H32N4/c1-2-18-7-4-16(5-8-18)20-11-9-19(10-12-20)14-15-3-6-17-13-15/h15-17H,2-14H2,1H3
InChIKeyAZDQARCPDBJUHT-UHFFFAOYSA-N
XLogP0.70
TPSA21.75 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(1-ethylpiperidin-4-yl)-4-(pyrrolidin-3-ylmethyl)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-(1-methylpiperidin-4-yl)-4-(piperidin-4-ylmethyl)piperazine
CID 167265149
ethane;4-ethyl-1-(pyrrolidin-3-ylmethyl)piperidine
CID 166478727
1-methyl-4-(pyrrolidin-3-ylmethyl)piperazine
CID 14627372
1-(4-ethylcyclohexyl)-4-(piperidin-4-ylmethyl)piperazine
CID 177134839
1-ethyl-4-pyrrolidin-3-yl-1,4-diazepane
CID 83618604
1-(azetidin-3-ylmethyl)-4-ethylpiperazine;ethane
CID 156885601
1-[[(3R)-pyrrolidin-3-yl]methyl]pyrrolidine
CID 58880458
4-piperidin-1-yl-1-(piperidin-4-ylmethyl)piperidine
CID 61244264
1-[[(3R)-pyrrolidin-3-yl]methyl]piperidin-4-ol
CID 86323550
1-[[(3R)-pyrrolidin-3-yl]methyl]piperidine
CID 86311653
1-ethyl-4-[(4-piperidin-4-ylpiperidin-1-yl)methyl]piperidine
CID 167091278
1-ethyl-N-methyl-N-(pyrrolidin-3-ylmethyl)piperidin-4-amine
CID 62370363

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylpiperidin-4-yl)-4-(pyrrolidin-3-ylmethyl)piperazine?
The IUPAC name of 1-(1-ethylpiperidin-4-yl)-4-(pyrrolidin-3-ylmethyl)piperazine (CID 170063851) is 1-(1-ethylpiperidin-4-yl)-4-(pyrrolidin-3-ylmethyl)piperazine.
What is the SMILES notation for 1-(1-ethylpiperidin-4-yl)-4-(pyrrolidin-3-ylmethyl)piperazine?
The canonical SMILES for 1-(1-ethylpiperidin-4-yl)-4-(pyrrolidin-3-ylmethyl)piperazine is CCN1CCC(N2CCN(CC3CCNC3)CC2)CC1.
What is the InChIKey of 1-(1-ethylpiperidin-4-yl)-4-(pyrrolidin-3-ylmethyl)piperazine?
The InChIKey is AZDQARCPDBJUHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N4/c1-2-18-7-4-16(5-8-18)20-11-9-19(10-12-20)14-15-3-6-17-13-15/h15-17H,2-14H2,1H3.
What are the key properties of 1-(1-ethylpiperidin-4-yl)-4-(pyrrolidin-3-ylmethyl)piperazine?
1-(1-ethylpiperidin-4-yl)-4-(pyrrolidin-3-ylmethyl)piperazine has a molecular weight of 280.46 g/mol, XLogP of 0.70, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylpiperidin-4-yl)-4-(pyrrolidin-3-ylmethyl)piperazine is sourced from PubChem (CID 170063851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).