1-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-yl)-N-(furan-2-ylmethyl)methanamine

C15H24N2O — CID 66470212

IUPAC1-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-yl)-N-(furan-2-ylmethyl)methanamine
SMILESc1coc(CNCC2CCC3CCCCC3N2)c1
InChIInChI=1S/C15H24N2O/c1-2-6-15-12(4-1)7-8-13(17-15)10-16-11-14-5-3-9-18-14/h3,5,9,12-13,15-17H,1-2,4,6-8,10-11H2
InChIKeyPPPQBFLFLTXJAE-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.68
Rot. Bonds4

About 1-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-yl)-N-(furan-2-ylmethyl)methanamine

1-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-yl)-N-(furan-2-ylmethyl)methanamine (PubChem CID 66470212) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 1-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-yl)-N-(furan-2-ylmethyl)methanamine.

Molecular Properties

Compound Name1-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-yl)-N-(furan-2-ylmethyl)methanamine
PubChem CID66470212
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name1-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-yl)-N-(furan-2-ylmethyl)methanamine
SMILESc1coc(CNCC2CCC3CCCCC3N2)c1
InChIInChI=1S/C15H24N2O/c1-2-6-15-12(4-1)7-8-13(17-15)10-16-11-14-5-3-9-18-14/h3,5,9,12-13,15-17H,1-2,4,6-8,10-11H2
InChIKeyPPPQBFLFLTXJAE-UHFFFAOYSA-N
XLogP2.68
TPSA37.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-yl)-N-(furan-2-ylmethyl)methanamine 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

1-(2,3,3a,4,5,6,7,7a-octahydro-1H-indol-2-yl)-N-(furan-2-ylmethyl)methanamine
CID 61150490
N-(2,3,3a,4,5,6,7,7a-octahydro-1H-indol-2-ylmethyl)-2-(furan-2-yl)ethanamine
CID 54954739
N-(furan-2-ylmethyl)-1-(oxan-2-yl)methanamine
CID 43403599
N-(furan-2-ylmethyl)-3-piperidin-2-ylpropan-1-amine
CID 62212334
N-(furan-2-ylmethyl)-1-(2-methylcyclopentyl)methanamine
CID 107178330
1-(1-ethylpiperidin-2-yl)-N-(furan-2-ylmethyl)methanamine
CID 115621753
1-(2,3-dihydro-1H-inden-2-yl)-N-(furan-2-ylmethyl)methanamine
CID 103675715
2-cyclohexyl-N-(furan-2-ylmethyl)cyclopropan-1-amine
CID 115655073
N-(furan-2-ylmethyl)-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 54878651
1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-yl(furan-2-yl)methanone
CID 116586098
N-cyclopentyl-2-(furan-2-ylmethylamino)acetamide
CID 28586516
N-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-ylmethyl)-2,4,4-trimethylpentan-2-amine
CID 66470624

Frequently Asked Questions

What is the IUPAC name of 1-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-yl)-N-(furan-2-ylmethyl)methanamine?
The IUPAC name of 1-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-yl)-N-(furan-2-ylmethyl)methanamine (CID 66470212) is 1-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-yl)-N-(furan-2-ylmethyl)methanamine.
What is the SMILES notation for 1-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-yl)-N-(furan-2-ylmethyl)methanamine?
The canonical SMILES for 1-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-yl)-N-(furan-2-ylmethyl)methanamine is c1coc(CNCC2CCC3CCCCC3N2)c1.
What is the InChIKey of 1-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-yl)-N-(furan-2-ylmethyl)methanamine?
The InChIKey is PPPQBFLFLTXJAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-2-6-15-12(4-1)7-8-13(17-15)10-16-11-14-5-3-9-18-14/h3,5,9,12-13,15-17H,1-2,4,6-8,10-11H2.
What are the key properties of 1-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-yl)-N-(furan-2-ylmethyl)methanamine?
1-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-yl)-N-(furan-2-ylmethyl)methanamine has a molecular weight of 248.37 g/mol, XLogP of 2.68, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-yl)-N-(furan-2-ylmethyl)methanamine is sourced from PubChem (CID 66470212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).