(2,2-dimethylmorpholin-4-yl)-(1H-indol-2-yl)methanone

C15H18N2O2 — CID 35020495

IUPAC(2,2-dimethylmorpholin-4-yl)-(1H-indol-2-yl)methanone
SMILESCC1(C)CN(C(=O)c2cc3ccccc3[nH]2)CCO1
InChIInChI=1S/C15H18N2O2/c1-15(2)10-17(7-8-19-15)14(18)13-9-11-5-3-4-6-12(11)16-13/h3-6,9,16H,7-8,10H2,1-2H3
InChIKeyJTSFQXGISIPVRO-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.42
Rot. Bonds1

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

(2,2-dimethylmorpholin-4-yl)-(1H-indol-2-yl)methanone (PubChem CID 35020495) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is (2,2-dimethylmorpholin-4-yl)-(1H-indol-2-yl)methanone.

Molecular Properties

Compound Name(2,2-dimethylmorpholin-4-yl)-(1H-indol-2-yl)methanone
PubChem CID35020495
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name(2,2-dimethylmorpholin-4-yl)-(1H-indol-2-yl)methanone
SMILESCC1(C)CN(C(=O)c2cc3ccccc3[nH]2)CCO1
InChIInChI=1S/C15H18N2O2/c1-15(2)10-17(7-8-19-15)14(18)13-9-11-5-3-4-6-12(11)16-13/h3-6,9,16H,7-8,10H2,1-2H3
InChIKeyJTSFQXGISIPVRO-UHFFFAOYSA-N
XLogP2.42
TPSA45.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1H-indol-2-yl(morpholin-4-yl)methanone
CID 825286
(4,4-dimethylpiperidin-1-yl)-(1H-indol-2-yl)methanone
CID 55155671
1H-indol-2-yl-(4-methylpiperazin-1-yl)methanone;hydrochloride
CID 134120748
[3-(4-fluorophenyl)-3-hydroxypyrrolidin-1-yl]-(1H-indol-2-yl)methanone
CID 138999905
(4,4-difluoropiperidin-1-yl)-(1H-indol-2-yl)methanone
CID 68887703
4-(1H-indole-2-carbonyl)-N,N-dimethylpiperazine-1-carboxamide
CID 34224299
1H-indol-2-yl(piperazin-1-yl)methanone;hydrochloride
CID 47003021
[(3S)-3-hydroxy-3-(hydroxymethyl)piperidin-1-yl]-(1H-indol-2-yl)methanone
CID 95718598
1H-indol-2-yl-(1-oxo-1,4-thiazinan-4-yl)methanone
CID 54975611
4-hydroxy-1-(1H-indole-2-carbonyl)piperidine-4-carboxylic acid
CID 119251399
N-[1-(1H-indole-2-carbonyl)piperidin-4-yl]acetamide
CID 49349124
furan-3-yl-[4-(1H-indole-2-carbonyl)piperazin-1-yl]methanone
CID 33018299

Frequently Asked Questions

What is the IUPAC name of (2,2-dimethylmorpholin-4-yl)-(1H-indol-2-yl)methanone?
The IUPAC name of (2,2-dimethylmorpholin-4-yl)-(1H-indol-2-yl)methanone (CID 35020495) is (2,2-dimethylmorpholin-4-yl)-(1H-indol-2-yl)methanone.
What is the SMILES notation for (2,2-dimethylmorpholin-4-yl)-(1H-indol-2-yl)methanone?
The canonical SMILES for (2,2-dimethylmorpholin-4-yl)-(1H-indol-2-yl)methanone is CC1(C)CN(C(=O)c2cc3ccccc3[nH]2)CCO1.
What is the InChIKey of (2,2-dimethylmorpholin-4-yl)-(1H-indol-2-yl)methanone?
The InChIKey is JTSFQXGISIPVRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-15(2)10-17(7-8-19-15)14(18)13-9-11-5-3-4-6-12(11)16-13/h3-6,9,16H,7-8,10H2,1-2H3.
What are the key properties of (2,2-dimethylmorpholin-4-yl)-(1H-indol-2-yl)methanone?
(2,2-dimethylmorpholin-4-yl)-(1H-indol-2-yl)methanone has a molecular weight of 258.32 g/mol, XLogP of 2.42, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2-dimethylmorpholin-4-yl)-(1H-indol-2-yl)methanone is sourced from PubChem (CID 35020495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).