(5-cyclopent-2-en-1-yl-4-methylpyrrolidin-3-yl)methanol

C11H19NO — CID 123628317

IUPAC(5-cyclopent-2-en-1-yl-4-methylpyrrolidin-3-yl)methanol
SMILESCC1C(CO)CNC1C1C=CCC1
InChIInChI=1S/C11H19NO/c1-8-10(7-13)6-12-11(8)9-4-2-3-5-9/h2,4,8-13H,3,5-7H2,1H3
InChIKeyJSRMDRXRYRDDPJ-UHFFFAOYSA-N
MW181.28 g/mol
LogP1.17
Rot. Bonds2

About (5-cyclopent-2-en-1-yl-4-methylpyrrolidin-3-yl)methanol

(5-cyclopent-2-en-1-yl-4-methylpyrrolidin-3-yl)methanol (PubChem CID 123628317) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is (5-cyclopent-2-en-1-yl-4-methylpyrrolidin-3-yl)methanol.

Molecular Properties

Compound Name(5-cyclopent-2-en-1-yl-4-methylpyrrolidin-3-yl)methanol
PubChem CID123628317
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name(5-cyclopent-2-en-1-yl-4-methylpyrrolidin-3-yl)methanol
SMILESCC1C(CO)CNC1C1C=CCC1
InChIInChI=1S/C11H19NO/c1-8-10(7-13)6-12-11(8)9-4-2-3-5-9/h2,4,8-13H,3,5-7H2,1H3
InChIKeyJSRMDRXRYRDDPJ-UHFFFAOYSA-N
XLogP1.17
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(6-fluoro-2,3,3a,6,7,7a-hexahydro-1H-indol-3-yl)methanol
CID 123939948
[(2S,4S)-4-cyclohex-2-en-1-ylpyrrolidin-2-yl]methanol
CID 56618141
1,2,3,3a,6,7,8,8a-Octahydrocyclohepta[b]pyrrol-3-yl(ethoxy)methanol
CID 59072056
[(2S)-4-cyclohex-2-en-1-ylpyrrolidin-2-yl]methanol
CID 70072919
(6-methyl-2,3,3a,6,7,7a-hexahydro-1H-indol-2-yl)methanol
CID 89219129
(1,4-Dimethyl-3-piperidin-3-yl-7-azabicyclo[2.2.1]hept-5-en-2-yl)methanol
CID 145815656
4-[[(2R,3S)-4-(hydroxymethyl)-2,3-dimethylpyrrolidin-2-yl]methyl]pent-4-en-1-ol
CID 147223439
(2,4-Dimethyl-6-azabicyclo[3.2.1]oct-3-en-8-yl)methanol
CID 23009504
[2-[[1-(2-Bicyclo[2.2.1]hept-5-enyl)ethylamino]methyl]cyclohexyl]methanol
CID 65904489
[2-[[1-(2-Bicyclo[2.2.1]hept-5-enyl)ethylamino]methyl]cyclopentyl]methanol
CID 65925420
4-[1-(2-Bicyclo[2.2.1]hept-5-enyl)ethylamino]-3-methylbutan-1-ol
CID 66092239
3-[[1-(2-Bicyclo[2.2.1]hept-5-enyl)ethylamino]methyl]pentan-1-ol
CID 80299594

Frequently Asked Questions

What is the IUPAC name of (5-cyclopent-2-en-1-yl-4-methylpyrrolidin-3-yl)methanol?
The IUPAC name of (5-cyclopent-2-en-1-yl-4-methylpyrrolidin-3-yl)methanol (CID 123628317) is (5-cyclopent-2-en-1-yl-4-methylpyrrolidin-3-yl)methanol.
What is the SMILES notation for (5-cyclopent-2-en-1-yl-4-methylpyrrolidin-3-yl)methanol?
The canonical SMILES for (5-cyclopent-2-en-1-yl-4-methylpyrrolidin-3-yl)methanol is CC1C(CO)CNC1C1C=CCC1.
What is the InChIKey of (5-cyclopent-2-en-1-yl-4-methylpyrrolidin-3-yl)methanol?
The InChIKey is JSRMDRXRYRDDPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO/c1-8-10(7-13)6-12-11(8)9-4-2-3-5-9/h2,4,8-13H,3,5-7H2,1H3.
What are the key properties of (5-cyclopent-2-en-1-yl-4-methylpyrrolidin-3-yl)methanol?
(5-cyclopent-2-en-1-yl-4-methylpyrrolidin-3-yl)methanol has a molecular weight of 181.28 g/mol, XLogP of 1.17, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-cyclopent-2-en-1-yl-4-methylpyrrolidin-3-yl)methanol is sourced from PubChem (CID 123628317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).