N-ethyl-5,8-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine

C16H20N2 — CID 55196533

IUPACN-ethyl-5,8-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
SMILESCCNc1c2c(nc3c(C)ccc(C)c13)CCC2
InChIInChI=1S/C16H20N2/c1-4-17-16-12-6-5-7-13(12)18-15-11(3)9-8-10(2)14(15)16/h8-9H,4-7H2,1-3H3,(H,17,18)
InChIKeyDFOKHOPJDPTXPW-UHFFFAOYSA-N
MW240.35 g/mol
LogP3.77
Rot. Bonds2

About N-ethyl-5,8-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine

N-ethyl-5,8-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine (PubChem CID 55196533) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-ethyl-5,8-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine.

Molecular Properties

Compound NameN-ethyl-5,8-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
PubChem CID55196533
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC NameN-ethyl-5,8-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
SMILESCCNc1c2c(nc3c(C)ccc(C)c13)CCC2
InChIInChI=1S/C16H20N2/c1-4-17-16-12-6-5-7-13(12)18-15-11(3)9-8-10(2)14(15)16/h8-9H,4-7H2,1-3H3,(H,17,18)
InChIKeyDFOKHOPJDPTXPW-UHFFFAOYSA-N
XLogP3.77
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-5,8-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The IUPAC name of N-ethyl-5,8-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine (CID 55196533) is N-ethyl-5,8-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine.
What is the SMILES notation for N-ethyl-5,8-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The canonical SMILES for N-ethyl-5,8-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine is CCNc1c2c(nc3c(C)ccc(C)c13)CCC2.
What is the InChIKey of N-ethyl-5,8-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The InChIKey is DFOKHOPJDPTXPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-4-17-16-12-6-5-7-13(12)18-15-11(3)9-8-10(2)14(15)16/h8-9H,4-7H2,1-3H3,(H,17,18).
What are the key properties of N-ethyl-5,8-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
N-ethyl-5,8-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine has a molecular weight of 240.35 g/mol, XLogP of 3.77, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5,8-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine is sourced from PubChem (CID 55196533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).