3-(3-ethylazetidin-1-yl)-1-methylpyrrolidine

C10H20N2 — CID 164846501

IUPAC3-(3-ethylazetidin-1-yl)-1-methylpyrrolidine
SMILESCCC1CN(C2CCN(C)C2)C1
InChIInChI=1S/C10H20N2/c1-3-9-6-12(7-9)10-4-5-11(2)8-10/h9-10H,3-8H2,1-2H3
InChIKeyYYBMBAHTWLXWLB-UHFFFAOYSA-N
MW168.28 g/mol
LogP1.03
Rot. Bonds2

About 3-(3-ethylazetidin-1-yl)-1-methylpyrrolidine

3-(3-ethylazetidin-1-yl)-1-methylpyrrolidine (PubChem CID 164846501) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is 3-(3-ethylazetidin-1-yl)-1-methylpyrrolidine.

Molecular Properties

Compound Name3-(3-ethylazetidin-1-yl)-1-methylpyrrolidine
PubChem CID164846501
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name3-(3-ethylazetidin-1-yl)-1-methylpyrrolidine
SMILESCCC1CN(C2CCN(C)C2)C1
InChIInChI=1S/C10H20N2/c1-3-9-6-12(7-9)10-4-5-11(2)8-10/h9-10H,3-8H2,1-2H3
InChIKeyYYBMBAHTWLXWLB-UHFFFAOYSA-N
XLogP1.03
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethyl-1-(1-methylazetidin-3-yl)azetidine
CID 164846605
2-methyl-5-(1-methylpyrrolidin-3-yl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole
CID 155218522
1-cyclopentyl-3-ethylazetidine
CID 126716457
1-methyl-4-[1-(1-methylpyrrolidin-3-yl)azetidin-3-yl]piperazine
CID 167091081
3-ethyl-1-methylpyrrolidine;methane
CID 161184146
4-methyl-1-(1-methylpyrrolidin-3-yl)piperidine
CID 126993329
ethane;1-(1-methylpyrrolidin-3-yl)azepane
CID 142272859
6-ethyl-1,4-dimethyl-1,4-diazocane
CID 174327849
1-[(3S)-1-methylpyrrolidin-3-yl]piperazine
CID 94910735
4-(1-methylpyrrolidin-3-yl)piperazin-1-amine
CID 177318483
4-iodo-3,4,5-trimethyl-1-(1-methylpyrrolidin-3-yl)piperidine
CID 167226853
3-(1-methylpyrrolidin-3-yl)-3,9-diazabicyclo[4.2.1]nonane
CID 115313910

Frequently Asked Questions

What is the IUPAC name of 3-(3-ethylazetidin-1-yl)-1-methylpyrrolidine?
The IUPAC name of 3-(3-ethylazetidin-1-yl)-1-methylpyrrolidine (CID 164846501) is 3-(3-ethylazetidin-1-yl)-1-methylpyrrolidine.
What is the SMILES notation for 3-(3-ethylazetidin-1-yl)-1-methylpyrrolidine?
The canonical SMILES for 3-(3-ethylazetidin-1-yl)-1-methylpyrrolidine is CCC1CN(C2CCN(C)C2)C1.
What is the InChIKey of 3-(3-ethylazetidin-1-yl)-1-methylpyrrolidine?
The InChIKey is YYBMBAHTWLXWLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-3-9-6-12(7-9)10-4-5-11(2)8-10/h9-10H,3-8H2,1-2H3.
What are the key properties of 3-(3-ethylazetidin-1-yl)-1-methylpyrrolidine?
3-(3-ethylazetidin-1-yl)-1-methylpyrrolidine has a molecular weight of 168.28 g/mol, XLogP of 1.03, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethylazetidin-1-yl)-1-methylpyrrolidine is sourced from PubChem (CID 164846501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).