2-(2,6-dimethylmorpholin-4-yl)-N-(1H-indol-4-ylmethyl)-2-methylpropan-1-amine

C19H29N3O — CID 119109871

IUPAC2-(2,6-dimethylmorpholin-4-yl)-N-(1H-indol-4-ylmethyl)-2-methylpropan-1-amine
SMILESCC1CN(C(C)(C)CNCc2cccc3[nH]ccc23)CC(C)O1
InChIInChI=1S/C19H29N3O/c1-14-11-22(12-15(2)23-14)19(3,4)13-20-10-16-6-5-7-18-17(16)8-9-21-18/h5-9,14-15,20-21H,10-13H2,1-4H3
InChIKeySIICRWVIVIQLCH-UHFFFAOYSA-N
MW315.46 g/mol
LogP3.15
Rot. Bonds5

About 2-(2,6-dimethylmorpholin-4-yl)-N-(1H-indol-4-ylmethyl)-2-methylpropan-1-amine

2-(2,6-dimethylmorpholin-4-yl)-N-(1H-indol-4-ylmethyl)-2-methylpropan-1-amine (PubChem CID 119109871) has the molecular formula C19H29N3O and a molecular weight of 315.46 g/mol. Its IUPAC name is 2-(2,6-dimethylmorpholin-4-yl)-N-(1H-indol-4-ylmethyl)-2-methylpropan-1-amine.

Molecular Properties

Compound Name2-(2,6-dimethylmorpholin-4-yl)-N-(1H-indol-4-ylmethyl)-2-methylpropan-1-amine
PubChem CID119109871
Molecular FormulaC19H29N3O
Molecular Weight315.46 g/mol
Exact Mass315.23
IUPAC Name2-(2,6-dimethylmorpholin-4-yl)-N-(1H-indol-4-ylmethyl)-2-methylpropan-1-amine
SMILESCC1CN(C(C)(C)CNCc2cccc3[nH]ccc23)CC(C)O1
InChIInChI=1S/C19H29N3O/c1-14-11-22(12-15(2)23-14)19(3,4)13-20-10-16-6-5-7-18-17(16)8-9-21-18/h5-9,14-15,20-21H,10-13H2,1-4H3
InChIKeySIICRWVIVIQLCH-UHFFFAOYSA-N
XLogP3.15
TPSA40.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.46
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-N-(1H-imidazol-2-ylmethyl)-2-methylpropan-1-amine
CID 124695769
1-(1H-indol-4-ylmethylamino)-2,3-dimethylbutan-2-ol
CID 111118493
2-ethyl-N-(1H-indol-4-ylmethyl)-2-methylsulfanylbutan-1-amine
CID 103702107
1-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-3-[2-(1H-indol-3-yl)ethyl]-2-methylguanidine;hydroiodide
CID 110997234
N-(1H-indol-4-ylmethyl)-2-(4-methylpiperidin-1-yl)ethanamine
CID 63002106
N-(1H-indol-4-ylmethyl)-1-(1-methylpiperidin-4-yl)methanamine
CID 63378381
N-(1H-indol-4-ylmethyl)-2-methylpropan-1-amine
CID 17221020
3-[(1H-indol-4-ylmethylamino)methyl]-2-methyloxolan-3-ol
CID 107268183
N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-2-oxo-1H-pyridine-3-carboxamide
CID 47020165
4-[(1H-indol-4-ylmethylamino)methyl]cyclohexan-1-ol
CID 106125391
N-(1H-indol-4-ylmethyl)-2-methyloxolan-3-amine
CID 82725136
N-(1H-indol-4-ylmethyl)-2-methyloxan-4-amine
CID 113346334

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylmorpholin-4-yl)-N-(1H-indol-4-ylmethyl)-2-methylpropan-1-amine?
The IUPAC name of 2-(2,6-dimethylmorpholin-4-yl)-N-(1H-indol-4-ylmethyl)-2-methylpropan-1-amine (CID 119109871) is 2-(2,6-dimethylmorpholin-4-yl)-N-(1H-indol-4-ylmethyl)-2-methylpropan-1-amine.
What is the SMILES notation for 2-(2,6-dimethylmorpholin-4-yl)-N-(1H-indol-4-ylmethyl)-2-methylpropan-1-amine?
The canonical SMILES for 2-(2,6-dimethylmorpholin-4-yl)-N-(1H-indol-4-ylmethyl)-2-methylpropan-1-amine is CC1CN(C(C)(C)CNCc2cccc3[nH]ccc23)CC(C)O1.
What is the InChIKey of 2-(2,6-dimethylmorpholin-4-yl)-N-(1H-indol-4-ylmethyl)-2-methylpropan-1-amine?
The InChIKey is SIICRWVIVIQLCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O/c1-14-11-22(12-15(2)23-14)19(3,4)13-20-10-16-6-5-7-18-17(16)8-9-21-18/h5-9,14-15,20-21H,10-13H2,1-4H3.
What are the key properties of 2-(2,6-dimethylmorpholin-4-yl)-N-(1H-indol-4-ylmethyl)-2-methylpropan-1-amine?
2-(2,6-dimethylmorpholin-4-yl)-N-(1H-indol-4-ylmethyl)-2-methylpropan-1-amine has a molecular weight of 315.46 g/mol, XLogP of 3.15, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylmorpholin-4-yl)-N-(1H-indol-4-ylmethyl)-2-methylpropan-1-amine is sourced from PubChem (CID 119109871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).