4-(1-aminopropyl)-2-methyl-5,6-dihydrocyclopenta[b]furan-4-ol

C11H17NO2 — CID 82400260

IUPAC4-(1-aminopropyl)-2-methyl-5,6-dihydrocyclopenta[b]furan-4-ol
SMILESCCC(N)C1(O)CCc2oc(C)cc21
InChIInChI=1S/C11H17NO2/c1-3-10(12)11(13)5-4-9-8(11)6-7(2)14-9/h6,10,13H,3-5,12H2,1-2H3
InChIKeyRODZLKGVEWVFMS-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.46
Rot. Bonds2

About 4-(1-aminopropyl)-2-methyl-5,6-dihydrocyclopenta[b]furan-4-ol

4-(1-aminopropyl)-2-methyl-5,6-dihydrocyclopenta[b]furan-4-ol (PubChem CID 82400260) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 4-(1-aminopropyl)-2-methyl-5,6-dihydrocyclopenta[b]furan-4-ol.

Molecular Properties

Compound Name4-(1-aminopropyl)-2-methyl-5,6-dihydrocyclopenta[b]furan-4-ol
PubChem CID82400260
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name4-(1-aminopropyl)-2-methyl-5,6-dihydrocyclopenta[b]furan-4-ol
SMILESCCC(N)C1(O)CCc2oc(C)cc21
InChIInChI=1S/C11H17NO2/c1-3-10(12)11(13)5-4-9-8(11)6-7(2)14-9/h6,10,13H,3-5,12H2,1-2H3
InChIKeyRODZLKGVEWVFMS-UHFFFAOYSA-N
XLogP1.46
TPSA59.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(1-aminopropyl)-2-methyl-5,6-dihydrocyclopenta[b]furan-4-ol?
The IUPAC name of 4-(1-aminopropyl)-2-methyl-5,6-dihydrocyclopenta[b]furan-4-ol (CID 82400260) is 4-(1-aminopropyl)-2-methyl-5,6-dihydrocyclopenta[b]furan-4-ol.
What is the SMILES notation for 4-(1-aminopropyl)-2-methyl-5,6-dihydrocyclopenta[b]furan-4-ol?
The canonical SMILES for 4-(1-aminopropyl)-2-methyl-5,6-dihydrocyclopenta[b]furan-4-ol is CCC(N)C1(O)CCc2oc(C)cc21.
What is the InChIKey of 4-(1-aminopropyl)-2-methyl-5,6-dihydrocyclopenta[b]furan-4-ol?
The InChIKey is RODZLKGVEWVFMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-3-10(12)11(13)5-4-9-8(11)6-7(2)14-9/h6,10,13H,3-5,12H2,1-2H3.
What are the key properties of 4-(1-aminopropyl)-2-methyl-5,6-dihydrocyclopenta[b]furan-4-ol?
4-(1-aminopropyl)-2-methyl-5,6-dihydrocyclopenta[b]furan-4-ol has a molecular weight of 195.26 g/mol, XLogP of 1.46, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-aminopropyl)-2-methyl-5,6-dihydrocyclopenta[b]furan-4-ol is sourced from PubChem (CID 82400260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).