9,9-dimethyl-10-propan-2-yl-4a,8a,9a,10a-tetrahydroacridine

C18H25N — CID 134249981

IUPAC9,9-dimethyl-10-propan-2-yl-4a,8a,9a,10a-tetrahydroacridine
SMILESCC(C)N1C2C=CC=CC2C(C)(C)C2C=CC=CC21
InChIInChI=1S/C18H25N/c1-13(2)19-16-11-7-5-9-14(16)18(3,4)15-10-6-8-12-17(15)19/h5-17H,1-4H3
InChIKeyHTDUAWDTWVIYNR-UHFFFAOYSA-N
MW255.41 g/mol
LogP3.96
Rot. Bonds1

About 9,9-dimethyl-10-propan-2-yl-4a,8a,9a,10a-tetrahydroacridine

9,9-dimethyl-10-propan-2-yl-4a,8a,9a,10a-tetrahydroacridine (PubChem CID 134249981) has the molecular formula C18H25N and a molecular weight of 255.41 g/mol. Its IUPAC name is 9,9-dimethyl-10-propan-2-yl-4a,8a,9a,10a-tetrahydroacridine.

Molecular Properties

Compound Name9,9-dimethyl-10-propan-2-yl-4a,8a,9a,10a-tetrahydroacridine
PubChem CID134249981
Molecular FormulaC18H25N
Molecular Weight255.41 g/mol
Exact Mass255.20
IUPAC Name9,9-dimethyl-10-propan-2-yl-4a,8a,9a,10a-tetrahydroacridine
SMILESCC(C)N1C2C=CC=CC2C(C)(C)C2C=CC=CC21
InChIInChI=1S/C18H25N/c1-13(2)19-16-11-7-5-9-14(16)18(3,4)15-10-6-8-12-17(15)19/h5-17H,1-4H3
InChIKeyHTDUAWDTWVIYNR-UHFFFAOYSA-N
XLogP3.96
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-10-propan-2-yl-4a,8a,9a,10a-tetrahydroacridine?
The IUPAC name of 9,9-dimethyl-10-propan-2-yl-4a,8a,9a,10a-tetrahydroacridine (CID 134249981) is 9,9-dimethyl-10-propan-2-yl-4a,8a,9a,10a-tetrahydroacridine.
What is the SMILES notation for 9,9-dimethyl-10-propan-2-yl-4a,8a,9a,10a-tetrahydroacridine?
The canonical SMILES for 9,9-dimethyl-10-propan-2-yl-4a,8a,9a,10a-tetrahydroacridine is CC(C)N1C2C=CC=CC2C(C)(C)C2C=CC=CC21.
What is the InChIKey of 9,9-dimethyl-10-propan-2-yl-4a,8a,9a,10a-tetrahydroacridine?
The InChIKey is HTDUAWDTWVIYNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N/c1-13(2)19-16-11-7-5-9-14(16)18(3,4)15-10-6-8-12-17(15)19/h5-17H,1-4H3.
What are the key properties of 9,9-dimethyl-10-propan-2-yl-4a,8a,9a,10a-tetrahydroacridine?
9,9-dimethyl-10-propan-2-yl-4a,8a,9a,10a-tetrahydroacridine has a molecular weight of 255.41 g/mol, XLogP of 3.96, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-10-propan-2-yl-4a,8a,9a,10a-tetrahydroacridine is sourced from PubChem (CID 134249981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).