(9-amino-5,6,7,8-tetrahydroacridin-4-yl)methanol

C14H16N2O — CID 11514130

IUPAC(9-amino-5,6,7,8-tetrahydroacridin-4-yl)methanol
SMILESNc1c2c(nc3c(CO)cccc13)CCCC2
InChIInChI=1S/C14H16N2O/c15-13-10-5-1-2-7-12(10)16-14-9(8-17)4-3-6-11(13)14/h3-4,6,17H,1-2,5,7-8H2,(H2,15,16)
InChIKeyLUWHOGXZYIVPJP-UHFFFAOYSA-N
MW228.29 g/mol
LogP2.19
Rot. Bonds1

About (9-amino-5,6,7,8-tetrahydroacridin-4-yl)methanol

(9-amino-5,6,7,8-tetrahydroacridin-4-yl)methanol (PubChem CID 11514130) has the molecular formula C14H16N2O and a molecular weight of 228.29 g/mol. Its IUPAC name is (9-amino-5,6,7,8-tetrahydroacridin-4-yl)methanol.

Molecular Properties

Compound Name(9-amino-5,6,7,8-tetrahydroacridin-4-yl)methanol
PubChem CID11514130
Molecular FormulaC14H16N2O
Molecular Weight228.29 g/mol
Exact Mass228.13
IUPAC Name(9-amino-5,6,7,8-tetrahydroacridin-4-yl)methanol
SMILESNc1c2c(nc3c(CO)cccc13)CCCC2
InChIInChI=1S/C14H16N2O/c15-13-10-5-1-2-7-12(10)16-14-9(8-17)4-3-6-11(13)14/h3-4,6,17H,1-2,5,7-8H2,(H2,15,16)
InChIKeyLUWHOGXZYIVPJP-UHFFFAOYSA-N
XLogP2.19
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (9-amino-5,6,7,8-tetrahydroacridin-4-yl)methanol?
The IUPAC name of (9-amino-5,6,7,8-tetrahydroacridin-4-yl)methanol (CID 11514130) is (9-amino-5,6,7,8-tetrahydroacridin-4-yl)methanol.
What is the SMILES notation for (9-amino-5,6,7,8-tetrahydroacridin-4-yl)methanol?
The canonical SMILES for (9-amino-5,6,7,8-tetrahydroacridin-4-yl)methanol is Nc1c2c(nc3c(CO)cccc13)CCCC2.
What is the InChIKey of (9-amino-5,6,7,8-tetrahydroacridin-4-yl)methanol?
The InChIKey is LUWHOGXZYIVPJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c15-13-10-5-1-2-7-12(10)16-14-9(8-17)4-3-6-11(13)14/h3-4,6,17H,1-2,5,7-8H2,(H2,15,16).
What are the key properties of (9-amino-5,6,7,8-tetrahydroacridin-4-yl)methanol?
(9-amino-5,6,7,8-tetrahydroacridin-4-yl)methanol has a molecular weight of 228.29 g/mol, XLogP of 2.19, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (9-amino-5,6,7,8-tetrahydroacridin-4-yl)methanol is sourced from PubChem (CID 11514130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).