1-(1H-indol-3-yl)-2-morpholin-4-ylpropan-1-one

C15H18N2O2 — CID 3768236

IUPAC1-(1H-indol-3-yl)-2-morpholin-4-ylpropan-1-one
SMILESCC(C(=O)c1c[nH]c2ccccc12)N1CCOCC1
InChIInChI=1S/C15H18N2O2/c1-11(17-6-8-19-9-7-17)15(18)13-10-16-14-5-3-2-4-12(13)14/h2-5,10-11,16H,6-9H2,1H3
InChIKeyPLOUGMVMGJBRBP-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.07
Rot. Bonds3

About 1-(1H-indol-3-yl)-2-morpholin-4-ylpropan-1-one

1-(1H-indol-3-yl)-2-morpholin-4-ylpropan-1-one (PubChem CID 3768236) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 1-(1H-indol-3-yl)-2-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name1-(1H-indol-3-yl)-2-morpholin-4-ylpropan-1-one
PubChem CID3768236
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name1-(1H-indol-3-yl)-2-morpholin-4-ylpropan-1-one
SMILESCC(C(=O)c1c[nH]c2ccccc12)N1CCOCC1
InChIInChI=1S/C15H18N2O2/c1-11(17-6-8-19-9-7-17)15(18)13-10-16-14-5-3-2-4-12(13)14/h2-5,10-11,16H,6-9H2,1H3
InChIKeyPLOUGMVMGJBRBP-UHFFFAOYSA-N
XLogP2.07
TPSA45.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Indole-3-Carboxaldehyde
CID 10256
Indoramin
CID 33625
Jwh-200
CID 10045570
(1-(2-(4-Morpholinyl)ethyl)-1H-indol-3-yl)(2,2,3,3-tetramethylcyclopropyl)methanone
CID 11584525
(1-((Tetrahydro-2H-pyran-4-yl)methyl)-1H-indol-3-yl)(2,2,3,3-tetramethylcyclopropyl)methanone
CID 11544639
L-Valine, N-((1-(5-fluoropentyl)-1H-indol-3-yl)carbonyl)-3-methyl-, methyl ester
CID 129597835
Indoramin hydrochloride
CID 38102
3-Acetylindole
CID 12802
(1-(2-Morpholin-4-ylethyl)indol-3-yl)-4-methylnaphthalen-1-ylmethanone
CID 10250276
1H-indole-3-carboxamide
CID 2192542
Indole, 3-(dimethylaminoacetyl)-
CID 34863
3-(Morpholinomethyl)indole
CID 21477

Frequently Asked Questions

What is the IUPAC name of 1-(1H-indol-3-yl)-2-morpholin-4-ylpropan-1-one?
The IUPAC name of 1-(1H-indol-3-yl)-2-morpholin-4-ylpropan-1-one (CID 3768236) is 1-(1H-indol-3-yl)-2-morpholin-4-ylpropan-1-one.
What is the SMILES notation for 1-(1H-indol-3-yl)-2-morpholin-4-ylpropan-1-one?
The canonical SMILES for 1-(1H-indol-3-yl)-2-morpholin-4-ylpropan-1-one is CC(C(=O)c1c[nH]c2ccccc12)N1CCOCC1.
What is the InChIKey of 1-(1H-indol-3-yl)-2-morpholin-4-ylpropan-1-one?
The InChIKey is PLOUGMVMGJBRBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-11(17-6-8-19-9-7-17)15(18)13-10-16-14-5-3-2-4-12(13)14/h2-5,10-11,16H,6-9H2,1H3.
What are the key properties of 1-(1H-indol-3-yl)-2-morpholin-4-ylpropan-1-one?
1-(1H-indol-3-yl)-2-morpholin-4-ylpropan-1-one has a molecular weight of 258.32 g/mol, XLogP of 2.07, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-indol-3-yl)-2-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 3768236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).