[3-(dimethylamino)-5-(1H-indol-4-yl)phenyl]-[2-(dimethylamino)-4-pyridinyl]methanone

C24H24N4O — CID 24960776

IUPAC[3-(dimethylamino)-5-(1H-indol-4-yl)phenyl]-[2-(dimethylamino)-4-pyridinyl]methanone
SMILESCN(C)c1cc(C(=O)c2ccnc(N(C)C)c2)cc(-c2cccc3[nH]ccc23)c1
InChIInChI=1S/C24H24N4O/c1-27(2)19-13-17(20-6-5-7-22-21(20)9-11-25-22)12-18(14-19)24(29)16-8-10-26-23(15-16)28(3)4/h5-15,25H,1-4H3
InChIKeyFKBSLXISFLAREV-UHFFFAOYSA-N
MW384.48 g/mol
LogP4.59
Rot. Bonds5

About [3-(dimethylamino)-5-(1H-indol-4-yl)phenyl]-[2-(dimethylamino)-4-pyridinyl]methanone

[3-(dimethylamino)-5-(1H-indol-4-yl)phenyl]-[2-(dimethylamino)-4-pyridinyl]methanone (PubChem CID 24960776) has the molecular formula C24H24N4O and a molecular weight of 384.48 g/mol. Its IUPAC name is [3-(dimethylamino)-5-(1H-indol-4-yl)phenyl]-[2-(dimethylamino)-4-pyridinyl]methanone.

Molecular Properties

Compound Name[3-(dimethylamino)-5-(1H-indol-4-yl)phenyl]-[2-(dimethylamino)-4-pyridinyl]methanone
PubChem CID24960776
Molecular FormulaC24H24N4O
Molecular Weight384.48 g/mol
Exact Mass384.20
IUPAC Name[3-(dimethylamino)-5-(1H-indol-4-yl)phenyl]-[2-(dimethylamino)-4-pyridinyl]methanone
SMILESCN(C)c1cc(C(=O)c2ccnc(N(C)C)c2)cc(-c2cccc3[nH]ccc23)c1
InChIInChI=1S/C24H24N4O/c1-27(2)19-13-17(20-6-5-7-22-21(20)9-11-25-22)12-18(14-19)24(29)16-8-10-26-23(15-16)28(3)4/h5-15,25H,1-4H3
InChIKeyFKBSLXISFLAREV-UHFFFAOYSA-N
XLogP4.59
TPSA52.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [3-(dimethylamino)-5-(1H-indol-4-yl)phenyl]-[2-(dimethylamino)-4-pyridinyl]methanone?
The IUPAC name of [3-(dimethylamino)-5-(1H-indol-4-yl)phenyl]-[2-(dimethylamino)-4-pyridinyl]methanone (CID 24960776) is [3-(dimethylamino)-5-(1H-indol-4-yl)phenyl]-[2-(dimethylamino)-4-pyridinyl]methanone.
What is the SMILES notation for [3-(dimethylamino)-5-(1H-indol-4-yl)phenyl]-[2-(dimethylamino)-4-pyridinyl]methanone?
The canonical SMILES for [3-(dimethylamino)-5-(1H-indol-4-yl)phenyl]-[2-(dimethylamino)-4-pyridinyl]methanone is CN(C)c1cc(C(=O)c2ccnc(N(C)C)c2)cc(-c2cccc3[nH]ccc23)c1.
What is the InChIKey of [3-(dimethylamino)-5-(1H-indol-4-yl)phenyl]-[2-(dimethylamino)-4-pyridinyl]methanone?
The InChIKey is FKBSLXISFLAREV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O/c1-27(2)19-13-17(20-6-5-7-22-21(20)9-11-25-22)12-18(14-19)24(29)16-8-10-26-23(15-16)28(3)4/h5-15,25H,1-4H3.
What are the key properties of [3-(dimethylamino)-5-(1H-indol-4-yl)phenyl]-[2-(dimethylamino)-4-pyridinyl]methanone?
[3-(dimethylamino)-5-(1H-indol-4-yl)phenyl]-[2-(dimethylamino)-4-pyridinyl]methanone has a molecular weight of 384.48 g/mol, XLogP of 4.59, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(dimethylamino)-5-(1H-indol-4-yl)phenyl]-[2-(dimethylamino)-4-pyridinyl]methanone is sourced from PubChem (CID 24960776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).