2,4-dimethyl-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroacridin-9-amine

C15H28N2 — CID 163156045

IUPAC2,4-dimethyl-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroacridin-9-amine
SMILESCC1CC(C)C2NC3CCCCC3C(N)C2C1
InChIInChI=1S/C15H28N2/c1-9-7-10(2)15-12(8-9)14(16)11-5-3-4-6-13(11)17-15/h9-15,17H,3-8,16H2,1-2H3
InChIKeyFTOOWFJRDJOTBN-UHFFFAOYSA-N
MW236.40 g/mol
LogP2.53
Rot. Bonds

About 2,4-dimethyl-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroacridin-9-amine

2,4-dimethyl-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroacridin-9-amine (PubChem CID 163156045) has the molecular formula C15H28N2 and a molecular weight of 236.40 g/mol. Its IUPAC name is 2,4-dimethyl-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroacridin-9-amine.

Molecular Properties

Compound Name2,4-dimethyl-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroacridin-9-amine
PubChem CID163156045
Molecular FormulaC15H28N2
Molecular Weight236.40 g/mol
Exact Mass236.23
IUPAC Name2,4-dimethyl-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroacridin-9-amine
SMILESCC1CC(C)C2NC3CCCCC3C(N)C2C1
InChIInChI=1S/C15H28N2/c1-9-7-10(2)15-12(8-9)14(16)11-5-3-4-6-13(11)17-15/h9-15,17H,3-8,16H2,1-2H3
InChIKeyFTOOWFJRDJOTBN-UHFFFAOYSA-N
XLogP2.53
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.40
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroacridin-9-amine?
The IUPAC name of 2,4-dimethyl-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroacridin-9-amine (CID 163156045) is 2,4-dimethyl-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroacridin-9-amine.
What is the SMILES notation for 2,4-dimethyl-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroacridin-9-amine?
The canonical SMILES for 2,4-dimethyl-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroacridin-9-amine is CC1CC(C)C2NC3CCCCC3C(N)C2C1.
What is the InChIKey of 2,4-dimethyl-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroacridin-9-amine?
The InChIKey is FTOOWFJRDJOTBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2/c1-9-7-10(2)15-12(8-9)14(16)11-5-3-4-6-13(11)17-15/h9-15,17H,3-8,16H2,1-2H3.
What are the key properties of 2,4-dimethyl-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroacridin-9-amine?
2,4-dimethyl-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroacridin-9-amine has a molecular weight of 236.40 g/mol, XLogP of 2.53, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroacridin-9-amine is sourced from PubChem (CID 163156045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).