1-ethyl-2-methyl-4-[[(2R)-pyrrolidin-2-yl]methyl]piperazine

C12H25N3 — CID 102819534

IUPAC1-ethyl-2-methyl-4-[[(2R)-pyrrolidin-2-yl]methyl]piperazine
SMILESCCN1CCN(C[C@H]2CCCN2)CC1C
InChIInChI=1S/C12H25N3/c1-3-15-8-7-14(9-11(15)2)10-12-5-4-6-13-12/h11-13H,3-10H2,1-2H3/t11?,12-/m1/s1
InChIKeyUQQZOVUKDMXOLB-PIJUOVFKSA-N
MW211.35 g/mol
LogP0.76
Rot. Bonds3

About 1-ethyl-2-methyl-4-[[(2R)-pyrrolidin-2-yl]methyl]piperazine

1-ethyl-2-methyl-4-[[(2R)-pyrrolidin-2-yl]methyl]piperazine (PubChem CID 102819534) has the molecular formula C12H25N3 and a molecular weight of 211.35 g/mol. Its IUPAC name is 1-ethyl-2-methyl-4-[[(2R)-pyrrolidin-2-yl]methyl]piperazine.

Molecular Properties

Compound Name1-ethyl-2-methyl-4-[[(2R)-pyrrolidin-2-yl]methyl]piperazine
PubChem CID102819534
Molecular FormulaC12H25N3
Molecular Weight211.35 g/mol
Exact Mass211.20
IUPAC Name1-ethyl-2-methyl-4-[[(2R)-pyrrolidin-2-yl]methyl]piperazine
SMILESCCN1CCN(C[C@H]2CCCN2)CC1C
InChIInChI=1S/C12H25N3/c1-3-15-8-7-14(9-11(15)2)10-12-5-4-6-13-12/h11-13H,3-10H2,1-2H3/t11?,12-/m1/s1
InChIKeyUQQZOVUKDMXOLB-PIJUOVFKSA-N
XLogP0.76
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-ethyl-2-methyl-4-[[(2R)-pyrrolidin-2-yl]methyl]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

2-Aminomethyl-1-ethylpyrrolidine
CID 117295
3-amino-N-ethylpiperidine
CID 98094
1-Pentylpiperazine
CID 2737112
3-Methyl-octahydropyrrolo(1,2-a)piperazine
CID 18958803
4-(1-Pyrrolidinyl)piperidine
CID 78703
Octahydropyrrolo(1,2-a)pyrazine
CID 558578
3-(Pyrrolidin-1-yl)piperidine
CID 573611
(S)-(-)-2-Aminomethyl-1-ethylpyrrolidine
CID 643457
(2R)-1-Ethyl-2-pyrrolidinemethanamine
CID 854138
N,N-diethylpiperidin-4-amine
CID 2758239
(1-Methylpiperidin-2-yl)methanamine
CID 2794677
1,2-Ethanediamine, N1-[2-(1-piperidinyl)ethyl]-
CID 79725

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-methyl-4-[[(2R)-pyrrolidin-2-yl]methyl]piperazine?
The IUPAC name of 1-ethyl-2-methyl-4-[[(2R)-pyrrolidin-2-yl]methyl]piperazine (CID 102819534) is 1-ethyl-2-methyl-4-[[(2R)-pyrrolidin-2-yl]methyl]piperazine.
What is the SMILES notation for 1-ethyl-2-methyl-4-[[(2R)-pyrrolidin-2-yl]methyl]piperazine?
The canonical SMILES for 1-ethyl-2-methyl-4-[[(2R)-pyrrolidin-2-yl]methyl]piperazine is CCN1CCN(C[C@H]2CCCN2)CC1C.
What is the InChIKey of 1-ethyl-2-methyl-4-[[(2R)-pyrrolidin-2-yl]methyl]piperazine?
The InChIKey is UQQZOVUKDMXOLB-PIJUOVFKSA-N. The full InChI is InChI=1S/C12H25N3/c1-3-15-8-7-14(9-11(15)2)10-12-5-4-6-13-12/h11-13H,3-10H2,1-2H3/t11?,12-/m1/s1.
What are the key properties of 1-ethyl-2-methyl-4-[[(2R)-pyrrolidin-2-yl]methyl]piperazine?
1-ethyl-2-methyl-4-[[(2R)-pyrrolidin-2-yl]methyl]piperazine has a molecular weight of 211.35 g/mol, XLogP of 0.76, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-methyl-4-[[(2R)-pyrrolidin-2-yl]methyl]piperazine is sourced from PubChem (CID 102819534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).