(2R)-2-[[(Z)-pent-2-enoxy]methyl]pyrrolidine

C10H19NO — CID 143435302

IUPAC(2R)-2-[[(Z)-pent-2-enoxy]methyl]pyrrolidine
SMILESCC/C=C\COC[C@H]1CCCN1
InChIInChI=1S/C10H19NO/c1-2-3-4-8-12-9-10-6-5-7-11-10/h3-4,10-11H,2,5-9H2,1H3/b4-3-/t10-/m1/s1
InChIKeyHCENFGJHJLJWOT-UMBAGQNISA-N
MW169.27 g/mol
LogP1.72
Rot. Bonds5

About (2R)-2-[[(Z)-pent-2-enoxy]methyl]pyrrolidine

(2R)-2-[[(Z)-pent-2-enoxy]methyl]pyrrolidine (PubChem CID 143435302) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is (2R)-2-[[(Z)-pent-2-enoxy]methyl]pyrrolidine.

Molecular Properties

Compound Name(2R)-2-[[(Z)-pent-2-enoxy]methyl]pyrrolidine
PubChem CID143435302
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name(2R)-2-[[(Z)-pent-2-enoxy]methyl]pyrrolidine
SMILESCC/C=C\COC[C@H]1CCCN1
InChIInChI=1S/C10H19NO/c1-2-3-4-8-12-9-10-6-5-7-11-10/h3-4,10-11H,2,5-9H2,1H3/b4-3-/t10-/m1/s1
InChIKeyHCENFGJHJLJWOT-UMBAGQNISA-N
XLogP1.72
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

6-[[(2S,4R)-4-fluoro-1-methylpyrrolidin-2-yl]methoxy]-1,2,3,6-tetrahydropyridine
CID 155676315
(2S)-2-(prop-2-enoxymethyl)pyrrolidine
CID 39063094
(2R)-2-(prop-2-enoxymethyl)pyrrolidine
CID 57985002
2-(Prop-2-enoxymethyl)pyrrolidine
CID 62333040
2-(Pent-4-enoxymethyl)pyrrolidine
CID 64313140
2-Prop-1-enyl-1-oxa-4-azaspiro[4.5]decane
CID 67423319
2-[(Z)-prop-1-enyl]-1-oxa-4-azaspiro[4.5]decane
CID 69304954
6-[(1-Methylpyrrolidin-2-yl)methoxy]-1,2,3,6-tetrahydropyridine
CID 141759705
2-[[(2E,4Z)-hepta-2,4-dien-3-yl]oxymethyl]pyrrolidine
CID 142125216
ethane;2-[[(2Z,5E)-5-[(2E,4Z)-hepta-2,4,6-trienoxy]octa-2,5,7-trienoxy]methyl]pyrrolidine
CID 143435369
(2R)-2-[[(3Z,5Z)-hepta-1,3,5-trien-2-yl]oxymethyl]pyrrolidine
CID 144029622
ethane;(2R)-2-[[(2E,4Z)-5-methylhepta-2,4,6-trien-3-yl]oxymethyl]pyrrolidine
CID 145472648

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[[(Z)-pent-2-enoxy]methyl]pyrrolidine?
The IUPAC name of (2R)-2-[[(Z)-pent-2-enoxy]methyl]pyrrolidine (CID 143435302) is (2R)-2-[[(Z)-pent-2-enoxy]methyl]pyrrolidine.
What is the SMILES notation for (2R)-2-[[(Z)-pent-2-enoxy]methyl]pyrrolidine?
The canonical SMILES for (2R)-2-[[(Z)-pent-2-enoxy]methyl]pyrrolidine is CC/C=C\COC[C@H]1CCCN1.
What is the InChIKey of (2R)-2-[[(Z)-pent-2-enoxy]methyl]pyrrolidine?
The InChIKey is HCENFGJHJLJWOT-UMBAGQNISA-N. The full InChI is InChI=1S/C10H19NO/c1-2-3-4-8-12-9-10-6-5-7-11-10/h3-4,10-11H,2,5-9H2,1H3/b4-3-/t10-/m1/s1.
What are the key properties of (2R)-2-[[(Z)-pent-2-enoxy]methyl]pyrrolidine?
(2R)-2-[[(Z)-pent-2-enoxy]methyl]pyrrolidine has a molecular weight of 169.27 g/mol, XLogP of 1.72, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[[(Z)-pent-2-enoxy]methyl]pyrrolidine is sourced from PubChem (CID 143435302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).