2,3,4,5,6,6a-hexahydrocyclopenta[b]furan-3a-ylmethanamine

C8H15NO — CID 126827532

IUPAC2,3,4,5,6,6a-hexahydrocyclopenta[b]furan-3a-ylmethanamine
SMILESNCC12CCCC1OCC2
InChIInChI=1S/C8H15NO/c9-6-8-3-1-2-7(8)10-5-4-8/h7H,1-6,9H2
InChIKeyXNVBUZNZIZXLRH-UHFFFAOYSA-N
MW141.21 g/mol
LogP0.90
Rot. Bonds1

About 2,3,4,5,6,6a-hexahydrocyclopenta[b]furan-3a-ylmethanamine

2,3,4,5,6,6a-hexahydrocyclopenta[b]furan-3a-ylmethanamine (PubChem CID 126827532) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 2,3,4,5,6,6a-hexahydrocyclopenta[b]furan-3a-ylmethanamine.

Molecular Properties

Compound Name2,3,4,5,6,6a-hexahydrocyclopenta[b]furan-3a-ylmethanamine
PubChem CID126827532
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name2,3,4,5,6,6a-hexahydrocyclopenta[b]furan-3a-ylmethanamine
SMILESNCC12CCCC1OCC2
InChIInChI=1S/C8H15NO/c9-6-8-3-1-2-7(8)10-5-4-8/h7H,1-6,9H2
InChIKeyXNVBUZNZIZXLRH-UHFFFAOYSA-N
XLogP0.90
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,3,4,5,6,6a-hexahydrocyclopenta[b]furan-3a-ylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[4-(oxolan-2-yl)oxan-4-yl]methanamine
CID 165486804
(3aR,6aS)-3a-(bromomethyl)-2,3,4,5,6,6a-hexahydrocyclopenta[b]furan
CID 125455786
[1,1-dioxo-4-(oxolan-2-yl)thian-4-yl]methanamine
CID 165475538
[(3aR,5R,7aR)-5-propan-2-yl-3,4,5,6,7,7a-hexahydro-2H-1-benzofuran-3a-yl]methanamine
CID 125456350
2-[1-(chloromethyl)cyclobutyl]oxane
CID 165443357
methyl 2-[[(3aR,6aR)-2,3,4,5,6,6a-hexahydrocyclopenta[b]furan-3a-yl]methylamino]acetate
CID 165450852
[(1R,3R)-3-[(6aR)-2,3,4,5,6,6a-hexahydrocyclopenta[b]furan-3a-yl]-2,2-dimethylcyclopropyl]methanamine
CID 178197076
3a-tert-butyl-2,3,4,5,6,6a-hexahydrocyclopenta[b]furan
CID 167376284
(1-cyclopropylcyclooctyl)methanamine
CID 130515109
1-[[(3aR,6aR)-2,3,4,5,6,6a-hexahydrocyclopenta[b]furan-3a-yl]methyl]-3-[3-(methanesulfonamido)cyclobutyl]-1-methylurea
CID 138010322
[4-(oxolan-3-yl)oxan-4-yl]methanamine
CID 126973588
(2-ethyl-1,3,4,5,6,6a-hexahydrocyclopenta[c]pyrrol-3a-yl)methanamine
CID 130591816

Frequently Asked Questions

What is the IUPAC name of 2,3,4,5,6,6a-hexahydrocyclopenta[b]furan-3a-ylmethanamine?
The IUPAC name of 2,3,4,5,6,6a-hexahydrocyclopenta[b]furan-3a-ylmethanamine (CID 126827532) is 2,3,4,5,6,6a-hexahydrocyclopenta[b]furan-3a-ylmethanamine.
What is the SMILES notation for 2,3,4,5,6,6a-hexahydrocyclopenta[b]furan-3a-ylmethanamine?
The canonical SMILES for 2,3,4,5,6,6a-hexahydrocyclopenta[b]furan-3a-ylmethanamine is NCC12CCCC1OCC2.
What is the InChIKey of 2,3,4,5,6,6a-hexahydrocyclopenta[b]furan-3a-ylmethanamine?
The InChIKey is XNVBUZNZIZXLRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c9-6-8-3-1-2-7(8)10-5-4-8/h7H,1-6,9H2.
What are the key properties of 2,3,4,5,6,6a-hexahydrocyclopenta[b]furan-3a-ylmethanamine?
2,3,4,5,6,6a-hexahydrocyclopenta[b]furan-3a-ylmethanamine has a molecular weight of 141.21 g/mol, XLogP of 0.90, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,5,6,6a-hexahydrocyclopenta[b]furan-3a-ylmethanamine is sourced from PubChem (CID 126827532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).