3-methyl-3-propylpyrrolidine;hydrochloride

C8H18ClN — CID 167717503

IUPAC3-methyl-3-propylpyrrolidine;hydrochloride
SMILESCCCC1(C)CCNC1.Cl
InChIInChI=1S/C8H17N.ClH/c1-3-4-8(2)5-6-9-7-8;/h9H,3-7H2,1-2H3;1H
InChIKeyAAWGCMGXDPGXQV-UHFFFAOYSA-N
MW163.69 g/mol
LogP2.21
Rot. Bonds2

About 3-methyl-3-propylpyrrolidine;hydrochloride

3-methyl-3-propylpyrrolidine;hydrochloride (PubChem CID 167717503) has the molecular formula C8H18ClN and a molecular weight of 163.69 g/mol. Its IUPAC name is 3-methyl-3-propylpyrrolidine;hydrochloride.

Molecular Properties

Compound Name3-methyl-3-propylpyrrolidine;hydrochloride
PubChem CID167717503
Molecular FormulaC8H18ClN
Molecular Weight163.69 g/mol
Exact Mass163.11
IUPAC Name3-methyl-3-propylpyrrolidine;hydrochloride
SMILESCCCC1(C)CCNC1.Cl
InChIInChI=1S/C8H17N.ClH/c1-3-4-8(2)5-6-9-7-8;/h9H,3-7H2,1-2H3;1H
InChIKeyAAWGCMGXDPGXQV-UHFFFAOYSA-N
XLogP2.21
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.69
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-3-propylpyrrolidine;hydrochloride?
The IUPAC name of 3-methyl-3-propylpyrrolidine;hydrochloride (CID 167717503) is 3-methyl-3-propylpyrrolidine;hydrochloride.
What is the SMILES notation for 3-methyl-3-propylpyrrolidine;hydrochloride?
The canonical SMILES for 3-methyl-3-propylpyrrolidine;hydrochloride is CCCC1(C)CCNC1.Cl.
What is the InChIKey of 3-methyl-3-propylpyrrolidine;hydrochloride?
The InChIKey is AAWGCMGXDPGXQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N.ClH/c1-3-4-8(2)5-6-9-7-8;/h9H,3-7H2,1-2H3;1H.
What are the key properties of 3-methyl-3-propylpyrrolidine;hydrochloride?
3-methyl-3-propylpyrrolidine;hydrochloride has a molecular weight of 163.69 g/mol, XLogP of 2.21, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3-propylpyrrolidine;hydrochloride is sourced from PubChem (CID 167717503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).