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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Related Compounds

2,4-dimethyl-6-propan-2-yl-6,7-dihydro-5H-1-benzofuran-4-ol;2-methylpropane
CID 155577682
4-butan-2-yl-6,7-dihydro-5H-1-benzofuran-4-ol
CID 115466987
4-(aminomethyl)-2-ethyl-6,7-dihydro-5H-1-benzofuran-4-ol
CID 83907829
ethyl 2-(1-hydroxy-7-methoxy-3,4-dihydro-2H-naphthalen-1-yl)propanoate
CID 70809295
ethyl 2-(1-hydroxy-6-methoxy-3,4-dihydro-2H-naphthalen-1-yl)butanoate
CID 62394893
2-(4-hydroxy-2,5-dimethyl-5,6-dihydrocyclopenta[b]furan-4-yl)acetic acid
CID 112716453
2-amino-3-methyl-N-(2,6,6-trimethyl-5,7-dihydro-4H-1-benzofuran-4-yl)pentanamide
CID 43713733
5-amino-1-[1-(ethylamino)ethyl]-2,3-dihydroinden-1-ol
CID 80562561
7-(aminomethyl)-2,6,6-trimethyl-4,5-dihydro-1-benzofuran-7-ol
CID 112716333
4-(1-aminoethyl)-6,7-dihydro-5H-2-benzothiophen-4-ol
CID 82398681
N-[[2-(2,5-dimethylfuran-3-yl)-2-methylcyclopropyl]methyl]-2-methylpropan-1-amine
CID 62713891
2-ethyl-4-hydroxy-6,7-dihydro-5H-1-benzofuran-4-carboxylic acid
CID 83909523

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).