9-(dimethylamino)-1-ethyl-11,11-dimethyl-3,4-dihydro-2H-naphtho[2,3-g]quinolin-6-one

C23H28N2O — CID 56959148

IUPAC9-(dimethylamino)-1-ethyl-11,11-dimethyl-3,4-dihydro-2H-naphtho[2,3-g]quinolin-6-one
SMILESCCN1CCCc2cc3c(cc21)C(C)(C)c1cc(N(C)C)ccc1C3=O
InChIInChI=1S/C23H28N2O/c1-6-25-11-7-8-15-12-18-20(14-21(15)25)23(2,3)19-13-16(24(4)5)9-10-17(19)22(18)26/h9-10,12-14H,6-8,11H2,1-5H3
InChIKeyAJAMMKRMEPXLKZ-UHFFFAOYSA-N
MW348.49 g/mol
LogP4.40
Rot. Bonds2

About 9-(dimethylamino)-1-ethyl-11,11-dimethyl-3,4-dihydro-2H-naphtho[2,3-g]quinolin-6-one

9-(dimethylamino)-1-ethyl-11,11-dimethyl-3,4-dihydro-2H-naphtho[2,3-g]quinolin-6-one (PubChem CID 56959148) has the molecular formula C23H28N2O and a molecular weight of 348.49 g/mol. Its IUPAC name is 9-(dimethylamino)-1-ethyl-11,11-dimethyl-3,4-dihydro-2H-naphtho[2,3-g]quinolin-6-one.

Molecular Properties

Compound Name9-(dimethylamino)-1-ethyl-11,11-dimethyl-3,4-dihydro-2H-naphtho[2,3-g]quinolin-6-one
PubChem CID56959148
Molecular FormulaC23H28N2O
Molecular Weight348.49 g/mol
Exact Mass348.22
IUPAC Name9-(dimethylamino)-1-ethyl-11,11-dimethyl-3,4-dihydro-2H-naphtho[2,3-g]quinolin-6-one
SMILESCCN1CCCc2cc3c(cc21)C(C)(C)c1cc(N(C)C)ccc1C3=O
InChIInChI=1S/C23H28N2O/c1-6-25-11-7-8-15-12-18-20(14-21(15)25)23(2,3)19-13-16(24(4)5)9-10-17(19)22(18)26/h9-10,12-14H,6-8,11H2,1-5H3
InChIKeyAJAMMKRMEPXLKZ-UHFFFAOYSA-N
XLogP4.40
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.49
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-(dimethylamino)-1-ethyl-11,11-dimethyl-3,4-dihydro-2H-naphtho[2,3-g]quinolin-6-one?
The IUPAC name of 9-(dimethylamino)-1-ethyl-11,11-dimethyl-3,4-dihydro-2H-naphtho[2,3-g]quinolin-6-one (CID 56959148) is 9-(dimethylamino)-1-ethyl-11,11-dimethyl-3,4-dihydro-2H-naphtho[2,3-g]quinolin-6-one.
What is the SMILES notation for 9-(dimethylamino)-1-ethyl-11,11-dimethyl-3,4-dihydro-2H-naphtho[2,3-g]quinolin-6-one?
The canonical SMILES for 9-(dimethylamino)-1-ethyl-11,11-dimethyl-3,4-dihydro-2H-naphtho[2,3-g]quinolin-6-one is CCN1CCCc2cc3c(cc21)C(C)(C)c1cc(N(C)C)ccc1C3=O.
What is the InChIKey of 9-(dimethylamino)-1-ethyl-11,11-dimethyl-3,4-dihydro-2H-naphtho[2,3-g]quinolin-6-one?
The InChIKey is AJAMMKRMEPXLKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O/c1-6-25-11-7-8-15-12-18-20(14-21(15)25)23(2,3)19-13-16(24(4)5)9-10-17(19)22(18)26/h9-10,12-14H,6-8,11H2,1-5H3.
What are the key properties of 9-(dimethylamino)-1-ethyl-11,11-dimethyl-3,4-dihydro-2H-naphtho[2,3-g]quinolin-6-one?
9-(dimethylamino)-1-ethyl-11,11-dimethyl-3,4-dihydro-2H-naphtho[2,3-g]quinolin-6-one has a molecular weight of 348.49 g/mol, XLogP of 4.40, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(dimethylamino)-1-ethyl-11,11-dimethyl-3,4-dihydro-2H-naphtho[2,3-g]quinolin-6-one is sourced from PubChem (CID 56959148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).