1H-indol-5-yl-(3-methylmorpholin-4-yl)methanone

C14H16N2O2 — CID 63717142

IUPAC1H-indol-5-yl-(3-methylmorpholin-4-yl)methanone
SMILESCC1COCCN1C(=O)c1ccc2[nH]ccc2c1
InChIInChI=1S/C14H16N2O2/c1-10-9-18-7-6-16(10)14(17)12-2-3-13-11(8-12)4-5-15-13/h2-5,8,10,15H,6-7,9H2,1H3
InChIKeyIAAHUCHWUUBPEW-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.03
Rot. Bonds1

About 1H-indol-5-yl-(3-methylmorpholin-4-yl)methanone

1H-indol-5-yl-(3-methylmorpholin-4-yl)methanone (PubChem CID 63717142) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 1H-indol-5-yl-(3-methylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name1H-indol-5-yl-(3-methylmorpholin-4-yl)methanone
PubChem CID63717142
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name1H-indol-5-yl-(3-methylmorpholin-4-yl)methanone
SMILESCC1COCCN1C(=O)c1ccc2[nH]ccc2c1
InChIInChI=1S/C14H16N2O2/c1-10-9-18-7-6-16(10)14(17)12-2-3-13-11(8-12)4-5-15-13/h2-5,8,10,15H,6-7,9H2,1H3
InChIKeyIAAHUCHWUUBPEW-UHFFFAOYSA-N
XLogP2.03
TPSA45.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-4-(1H-indole-5-carbonyl)morpholine-3-carboxylic acid
CID 124513582
(2,4-dimethylpiperidin-1-yl)-(1H-indol-5-yl)methanone
CID 55236063
(3,4-difluorophenyl)-(3-methylmorpholin-4-yl)methanone
CID 110292238
[3-(hydroxymethyl)morpholin-4-yl]-(1H-indol-6-yl)methanone
CID 112531994
(3-methylmorpholin-4-yl)-(3-phenylphenyl)methanone
CID 110292242
1H-indol-7-yl-[(3R)-3-methylmorpholin-4-yl]methanone
CID 106834546
[4-bromo-3-(trifluoromethyl)phenyl]-[(3R)-3-methylmorpholin-4-yl]methanone
CID 106832464
1H-indol-6-yl-[(3R)-3-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]methanone
CID 129474082
(2-bromo-4-pyridinyl)-[(3R)-3-methylmorpholin-4-yl]methanone
CID 106832524
(3,4-dipropoxyphenyl)-[(3S)-3-methylmorpholin-4-yl]methanone
CID 51938117
[3-(methylamino)-4-nitrophenyl]-(3-methylmorpholin-4-yl)methanone
CID 62680319
[4-(aminomethyl)phenyl]-(3-methylmorpholin-4-yl)methanone;hydrochloride
CID 119293249

Frequently Asked Questions

What is the IUPAC name of 1H-indol-5-yl-(3-methylmorpholin-4-yl)methanone?
The IUPAC name of 1H-indol-5-yl-(3-methylmorpholin-4-yl)methanone (CID 63717142) is 1H-indol-5-yl-(3-methylmorpholin-4-yl)methanone.
What is the SMILES notation for 1H-indol-5-yl-(3-methylmorpholin-4-yl)methanone?
The canonical SMILES for 1H-indol-5-yl-(3-methylmorpholin-4-yl)methanone is CC1COCCN1C(=O)c1ccc2[nH]ccc2c1.
What is the InChIKey of 1H-indol-5-yl-(3-methylmorpholin-4-yl)methanone?
The InChIKey is IAAHUCHWUUBPEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-10-9-18-7-6-16(10)14(17)12-2-3-13-11(8-12)4-5-15-13/h2-5,8,10,15H,6-7,9H2,1H3.
What are the key properties of 1H-indol-5-yl-(3-methylmorpholin-4-yl)methanone?
1H-indol-5-yl-(3-methylmorpholin-4-yl)methanone has a molecular weight of 244.29 g/mol, XLogP of 2.03, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-indol-5-yl-(3-methylmorpholin-4-yl)methanone is sourced from PubChem (CID 63717142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).