N-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-1-(2-morpholin-4-ylethyl)indol-5-amine

C26H37N3O2Si — CID 140719406

IUPACN-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-1-(2-morpholin-4-ylethyl)indol-5-amine
SMILESCC(C)(C)[Si](C)(C)Oc1ccc(Nc2ccc3c(ccn3CCN3CCOCC3)c2)cc1
InChIInChI=1S/C26H37N3O2Si/c1-26(2,3)32(4,5)31-24-9-6-22(7-10-24)27-23-8-11-25-21(20-23)12-13-29(25)15-14-28-16-18-30-19-17-28/h6-13,20,27H,14-19H2,1-5H3
InChIKeyBJPQIZBMAVINKV-UHFFFAOYSA-N
MW451.69 g/mol
LogP6.10
Rot. Bonds7

About N-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-1-(2-morpholin-4-ylethyl)indol-5-amine

N-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-1-(2-morpholin-4-ylethyl)indol-5-amine (PubChem CID 140719406) has the molecular formula C26H37N3O2Si and a molecular weight of 451.69 g/mol. Its IUPAC name is N-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-1-(2-morpholin-4-ylethyl)indol-5-amine.

Molecular Properties

Compound NameN-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-1-(2-morpholin-4-ylethyl)indol-5-amine
PubChem CID140719406
Molecular FormulaC26H37N3O2Si
Molecular Weight451.69 g/mol
Exact Mass451.27
IUPAC NameN-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-1-(2-morpholin-4-ylethyl)indol-5-amine
SMILESCC(C)(C)[Si](C)(C)Oc1ccc(Nc2ccc3c(ccn3CCN3CCOCC3)c2)cc1
InChIInChI=1S/C26H37N3O2Si/c1-26(2,3)32(4,5)31-24-9-6-22(7-10-24)27-23-8-11-25-21(20-23)12-13-29(25)15-14-28-16-18-30-19-17-28/h6-13,20,27H,14-19H2,1-5H3
InChIKeyBJPQIZBMAVINKV-UHFFFAOYSA-N
XLogP6.10
TPSA38.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500451.69
LogP ≤ 56.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

2-amino-2-methyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pentanamide;dihydrochloride
CID 119864723
1-[1-(2-morpholin-4-ylethyl)indol-5-yl]-3-[(4-propan-2-yloxyphenyl)methyl]urea
CID 56557266
3-amino-2-methyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]butanamide;dihydrochloride
CID 120503366
4-(cyclopropanecarbonyl)-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]piperazine-1-carboxamide
CID 56556621
1-[2-(aziridin-1-yl)ethyl]-5-(trifluoromethoxy)indole
CID 154694278
1-[1-(2-morpholin-4-ylethyl)indol-5-yl]-3-(2-morpholin-4-ylpropyl)urea
CID 56556947
1-hexyl-3-[1-(2-morpholin-4-ylethyl)indol-5-yl]urea
CID 56557196
1-[2-(3-methoxyphenoxy)ethyl]-3-[1-(2-morpholin-4-ylethyl)indol-5-yl]urea
CID 56556653
1-(3-morpholin-4-ylpropyl)indol-5-amine
CID 170992123
(2R)-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]oxolane-2-carboxamide
CID 94391676
1-methyl-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-[1-(2-morpholin-4-ylethyl)indol-5-yl]urea
CID 126773392
N-[3-[[[1-(2-morpholin-4-ylethyl)indol-5-yl]carbamoylamino]methyl]phenyl]acetamide
CID 56556717

Frequently Asked Questions

What is the IUPAC name of N-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-1-(2-morpholin-4-ylethyl)indol-5-amine?
The IUPAC name of N-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-1-(2-morpholin-4-ylethyl)indol-5-amine (CID 140719406) is N-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-1-(2-morpholin-4-ylethyl)indol-5-amine.
What is the SMILES notation for N-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-1-(2-morpholin-4-ylethyl)indol-5-amine?
The canonical SMILES for N-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-1-(2-morpholin-4-ylethyl)indol-5-amine is CC(C)(C)[Si](C)(C)Oc1ccc(Nc2ccc3c(ccn3CCN3CCOCC3)c2)cc1.
What is the InChIKey of N-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-1-(2-morpholin-4-ylethyl)indol-5-amine?
The InChIKey is BJPQIZBMAVINKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H37N3O2Si/c1-26(2,3)32(4,5)31-24-9-6-22(7-10-24)27-23-8-11-25-21(20-23)12-13-29(25)15-14-28-16-18-30-19-17-28/h6-13,20,27H,14-19H2,1-5H3.
What are the key properties of N-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-1-(2-morpholin-4-ylethyl)indol-5-amine?
N-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-1-(2-morpholin-4-ylethyl)indol-5-amine has a molecular weight of 451.69 g/mol, XLogP of 6.10, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-1-(2-morpholin-4-ylethyl)indol-5-amine is sourced from PubChem (CID 140719406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).