6,7-dihydrocyclopenta[c]pyran-5-ylmethanamine

C9H11NO — CID 71777058

IUPAC6,7-dihydrocyclopenta[c]pyran-5-ylmethanamine
SMILESNCC1=C2C=COC=C2CC1
InChIInChI=1S/C9H11NO/c10-5-7-1-2-8-6-11-4-3-9(7)8/h3-4,6H,1-2,5,10H2
InChIKeyNKATVRKTJMDFFG-UHFFFAOYSA-N
MW149.19 g/mol
LogP1.46
Rot. Bonds1

About 6,7-dihydrocyclopenta[c]pyran-5-ylmethanamine

6,7-dihydrocyclopenta[c]pyran-5-ylmethanamine (PubChem CID 71777058) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is 6,7-dihydrocyclopenta[c]pyran-5-ylmethanamine.

Molecular Properties

Compound Name6,7-dihydrocyclopenta[c]pyran-5-ylmethanamine
PubChem CID71777058
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name6,7-dihydrocyclopenta[c]pyran-5-ylmethanamine
SMILESNCC1=C2C=COC=C2CC1
InChIInChI=1S/C9H11NO/c10-5-7-1-2-8-6-11-4-3-9(7)8/h3-4,6H,1-2,5,10H2
InChIKeyNKATVRKTJMDFFG-UHFFFAOYSA-N
XLogP1.46
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6,7-dihydrocyclopenta[c]pyran-5-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

2-(6,7-Dihydrocyclopenta[c]pyran-5-yl)ethanamine
CID 90073157
2-[(5Z,6Z)-6-ethylidene-5-[(E)-3-methoxyprop-2-enylidene]cyclohepta-1,3-dien-1-yl]ethanamine
CID 143088497
(Z,2Z,3E)-3-(methoxymethylidene)-4-methylidene-2-prop-2-enylidenenon-7-en-1-amine
CID 146489352

Frequently Asked Questions

What is the IUPAC name of 6,7-dihydrocyclopenta[c]pyran-5-ylmethanamine?
The IUPAC name of 6,7-dihydrocyclopenta[c]pyran-5-ylmethanamine (CID 71777058) is 6,7-dihydrocyclopenta[c]pyran-5-ylmethanamine.
What is the SMILES notation for 6,7-dihydrocyclopenta[c]pyran-5-ylmethanamine?
The canonical SMILES for 6,7-dihydrocyclopenta[c]pyran-5-ylmethanamine is NCC1=C2C=COC=C2CC1.
What is the InChIKey of 6,7-dihydrocyclopenta[c]pyran-5-ylmethanamine?
The InChIKey is NKATVRKTJMDFFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c10-5-7-1-2-8-6-11-4-3-9(7)8/h3-4,6H,1-2,5,10H2.
What are the key properties of 6,7-dihydrocyclopenta[c]pyran-5-ylmethanamine?
6,7-dihydrocyclopenta[c]pyran-5-ylmethanamine has a molecular weight of 149.19 g/mol, XLogP of 1.46, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dihydrocyclopenta[c]pyran-5-ylmethanamine is sourced from PubChem (CID 71777058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).