(2,4-dimethylpiperidin-1-yl)-(1H-indol-5-yl)methanone

C16H20N2O — CID 55236063

IUPAC(2,4-dimethylpiperidin-1-yl)-(1H-indol-5-yl)methanone
SMILESCC1CCN(C(=O)c2ccc3[nH]ccc3c2)C(C)C1
InChIInChI=1S/C16H20N2O/c1-11-6-8-18(12(2)9-11)16(19)14-3-4-15-13(10-14)5-7-17-15/h3-5,7,10-12,17H,6,8-9H2,1-2H3
InChIKeyIHILZRAVAPSNRM-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.43
Rot. Bonds1

About (2,4-dimethylpiperidin-1-yl)-(1H-indol-5-yl)methanone

(2,4-dimethylpiperidin-1-yl)-(1H-indol-5-yl)methanone (PubChem CID 55236063) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is (2,4-dimethylpiperidin-1-yl)-(1H-indol-5-yl)methanone.

Molecular Properties

Compound Name(2,4-dimethylpiperidin-1-yl)-(1H-indol-5-yl)methanone
PubChem CID55236063
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name(2,4-dimethylpiperidin-1-yl)-(1H-indol-5-yl)methanone
SMILESCC1CCN(C(=O)c2ccc3[nH]ccc3c2)C(C)C1
InChIInChI=1S/C16H20N2O/c1-11-6-8-18(12(2)9-11)16(19)14-3-4-15-13(10-14)5-7-17-15/h3-5,7,10-12,17H,6,8-9H2,1-2H3
InChIKeyIHILZRAVAPSNRM-UHFFFAOYSA-N
XLogP3.43
TPSA36.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (2,4-dimethylpiperidin-1-yl)-(1H-indol-5-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1H-indol-5-yl-(3-methylmorpholin-4-yl)methanone
CID 63717142
(2,4-dimethylpiperidin-1-yl)-(3-hydroxy-4-methylphenyl)methanone
CID 62330190
[(2S,3R)-2-benzyl-3-hydroxypyrrolidin-1-yl]-(1H-indol-5-yl)methanone
CID 97470101
1-(1H-indole-5-carbonyl)pyrrolidine-2-carboxamide
CID 63723246
1-(1H-indole-5-carbonyl)piperidine-2-carboxamide
CID 63719368
1-(1H-indole-5-carbonyl)-N-methylpiperidine-2-carboxamide
CID 63716587
4-(4-methoxy-2-methylpiperidine-1-carbonyl)-1H-pyridin-2-one
CID 114221445
[4-[(dimethylamino)methyl]piperidin-1-yl]-(1H-indol-5-yl)methanone
CID 63723758
[(3aS,6aR)-1-pyrimidin-2-yl-2,3,3a,5,6,6a-hexahydropyrrolo[3,2-b]pyrrol-4-yl]-(1H-indol-5-yl)methanone
CID 124802198
2-chloro-5-(2,4-dimethylpiperidine-1-carbonyl)benzenesulfonamide
CID 65387685
1H-indol-5-yl-[2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]methanone
CID 63717325
[3-(1-hydroxyethyl)pyrrolidin-1-yl]-(1H-indol-5-yl)methanone
CID 112627387

Frequently Asked Questions

What is the IUPAC name of (2,4-dimethylpiperidin-1-yl)-(1H-indol-5-yl)methanone?
The IUPAC name of (2,4-dimethylpiperidin-1-yl)-(1H-indol-5-yl)methanone (CID 55236063) is (2,4-dimethylpiperidin-1-yl)-(1H-indol-5-yl)methanone.
What is the SMILES notation for (2,4-dimethylpiperidin-1-yl)-(1H-indol-5-yl)methanone?
The canonical SMILES for (2,4-dimethylpiperidin-1-yl)-(1H-indol-5-yl)methanone is CC1CCN(C(=O)c2ccc3[nH]ccc3c2)C(C)C1.
What is the InChIKey of (2,4-dimethylpiperidin-1-yl)-(1H-indol-5-yl)methanone?
The InChIKey is IHILZRAVAPSNRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-11-6-8-18(12(2)9-11)16(19)14-3-4-15-13(10-14)5-7-17-15/h3-5,7,10-12,17H,6,8-9H2,1-2H3.
What are the key properties of (2,4-dimethylpiperidin-1-yl)-(1H-indol-5-yl)methanone?
(2,4-dimethylpiperidin-1-yl)-(1H-indol-5-yl)methanone has a molecular weight of 256.35 g/mol, XLogP of 3.43, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dimethylpiperidin-1-yl)-(1H-indol-5-yl)methanone is sourced from PubChem (CID 55236063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).