2-cyclopropyl-2-(methoxymethyl)pyrrolidine;hydrochloride

C9H18ClNO — CID 91647507

IUPAC2-cyclopropyl-2-(methoxymethyl)pyrrolidine;hydrochloride
SMILESCOCC1(C2CC2)CCCN1.Cl
InChIInChI=1S/C9H17NO.ClH/c1-11-7-9(8-3-4-8)5-2-6-10-9;/h8,10H,2-7H2,1H3;1H
InChIKeyDOESLHIJWUZDQZ-UHFFFAOYSA-N
MW191.70 g/mol
LogP1.59
Rot. Bonds3

About 2-cyclopropyl-2-(methoxymethyl)pyrrolidine;hydrochloride

2-cyclopropyl-2-(methoxymethyl)pyrrolidine;hydrochloride (PubChem CID 91647507) has the molecular formula C9H18ClNO and a molecular weight of 191.70 g/mol. Its IUPAC name is 2-cyclopropyl-2-(methoxymethyl)pyrrolidine;hydrochloride.

Molecular Properties

Compound Name2-cyclopropyl-2-(methoxymethyl)pyrrolidine;hydrochloride
PubChem CID91647507
Molecular FormulaC9H18ClNO
Molecular Weight191.70 g/mol
Exact Mass191.11
IUPAC Name2-cyclopropyl-2-(methoxymethyl)pyrrolidine;hydrochloride
SMILESCOCC1(C2CC2)CCCN1.Cl
InChIInChI=1S/C9H17NO.ClH/c1-11-7-9(8-3-4-8)5-2-6-10-9;/h8,10H,2-7H2,1H3;1H
InChIKeyDOESLHIJWUZDQZ-UHFFFAOYSA-N
XLogP1.59
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.70
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-(methoxymethyl)pyrrolidine;hydrochloride?
The IUPAC name of 2-cyclopropyl-2-(methoxymethyl)pyrrolidine;hydrochloride (CID 91647507) is 2-cyclopropyl-2-(methoxymethyl)pyrrolidine;hydrochloride.
What is the SMILES notation for 2-cyclopropyl-2-(methoxymethyl)pyrrolidine;hydrochloride?
The canonical SMILES for 2-cyclopropyl-2-(methoxymethyl)pyrrolidine;hydrochloride is COCC1(C2CC2)CCCN1.Cl.
What is the InChIKey of 2-cyclopropyl-2-(methoxymethyl)pyrrolidine;hydrochloride?
The InChIKey is DOESLHIJWUZDQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO.ClH/c1-11-7-9(8-3-4-8)5-2-6-10-9;/h8,10H,2-7H2,1H3;1H.
What are the key properties of 2-cyclopropyl-2-(methoxymethyl)pyrrolidine;hydrochloride?
2-cyclopropyl-2-(methoxymethyl)pyrrolidine;hydrochloride has a molecular weight of 191.70 g/mol, XLogP of 1.59, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(methoxymethyl)pyrrolidine;hydrochloride is sourced from PubChem (CID 91647507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).