10-chloro-5-[3-(dimethylamino)propyl]-7H-indolo[2,3-c]quinolin-6-one

C20H20ClN3O — CID 21445423

IUPAC10-chloro-5-[3-(dimethylamino)propyl]-7H-indolo[2,3-c]quinolin-6-one
SMILESCN(C)CCCn1c(=O)c2[nH]c3ccc(Cl)cc3c2c2ccccc21
InChIInChI=1S/C20H20ClN3O/c1-23(2)10-5-11-24-17-7-4-3-6-14(17)18-15-12-13(21)8-9-16(15)22-19(18)20(24)25/h3-4,6-9,12,22H,5,10-11H2,1-2H3
InChIKeyLCHDIMKAZROGRX-UHFFFAOYSA-N
MW353.85 g/mol
LogP4.24
Rot. Bonds4

About 10-chloro-5-[3-(dimethylamino)propyl]-7H-indolo[2,3-c]quinolin-6-one

10-chloro-5-[3-(dimethylamino)propyl]-7H-indolo[2,3-c]quinolin-6-one (PubChem CID 21445423) has the molecular formula C20H20ClN3O and a molecular weight of 353.85 g/mol. Its IUPAC name is 10-chloro-5-[3-(dimethylamino)propyl]-7H-indolo[2,3-c]quinolin-6-one.

Molecular Properties

Compound Name10-chloro-5-[3-(dimethylamino)propyl]-7H-indolo[2,3-c]quinolin-6-one
PubChem CID21445423
Molecular FormulaC20H20ClN3O
Molecular Weight353.85 g/mol
Exact Mass353.13
IUPAC Name10-chloro-5-[3-(dimethylamino)propyl]-7H-indolo[2,3-c]quinolin-6-one
SMILESCN(C)CCCn1c(=O)c2[nH]c3ccc(Cl)cc3c2c2ccccc21
InChIInChI=1S/C20H20ClN3O/c1-23(2)10-5-11-24-17-7-4-3-6-14(17)18-15-12-13(21)8-9-16(15)22-19(18)20(24)25/h3-4,6-9,12,22H,5,10-11H2,1-2H3
InChIKeyLCHDIMKAZROGRX-UHFFFAOYSA-N
XLogP4.24
TPSA41.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.85
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 10-chloro-5-[3-(dimethylamino)propyl]-7H-indolo[2,3-c]quinolin-6-one?
The IUPAC name of 10-chloro-5-[3-(dimethylamino)propyl]-7H-indolo[2,3-c]quinolin-6-one (CID 21445423) is 10-chloro-5-[3-(dimethylamino)propyl]-7H-indolo[2,3-c]quinolin-6-one.
What is the SMILES notation for 10-chloro-5-[3-(dimethylamino)propyl]-7H-indolo[2,3-c]quinolin-6-one?
The canonical SMILES for 10-chloro-5-[3-(dimethylamino)propyl]-7H-indolo[2,3-c]quinolin-6-one is CN(C)CCCn1c(=O)c2[nH]c3ccc(Cl)cc3c2c2ccccc21.
What is the InChIKey of 10-chloro-5-[3-(dimethylamino)propyl]-7H-indolo[2,3-c]quinolin-6-one?
The InChIKey is LCHDIMKAZROGRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20ClN3O/c1-23(2)10-5-11-24-17-7-4-3-6-14(17)18-15-12-13(21)8-9-16(15)22-19(18)20(24)25/h3-4,6-9,12,22H,5,10-11H2,1-2H3.
What are the key properties of 10-chloro-5-[3-(dimethylamino)propyl]-7H-indolo[2,3-c]quinolin-6-one?
10-chloro-5-[3-(dimethylamino)propyl]-7H-indolo[2,3-c]quinolin-6-one has a molecular weight of 353.85 g/mol, XLogP of 4.24, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-chloro-5-[3-(dimethylamino)propyl]-7H-indolo[2,3-c]quinolin-6-one is sourced from PubChem (CID 21445423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).