1-(1-ethylindol-7-yl)-2-methylpropan-2-ol

C14H19NO — CID 115115004

IUPAC1-(1-ethylindol-7-yl)-2-methylpropan-2-ol
SMILESCCn1ccc2cccc(CC(C)(C)O)c21
InChIInChI=1S/C14H19NO/c1-4-15-9-8-11-6-5-7-12(13(11)15)10-14(2,3)16/h5-9,16H,4,10H2,1-3H3
InChIKeyBVMUBWKQZVJJEW-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.97
Rot. Bonds3

About 1-(1-ethylindol-7-yl)-2-methylpropan-2-ol

1-(1-ethylindol-7-yl)-2-methylpropan-2-ol (PubChem CID 115115004) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 1-(1-ethylindol-7-yl)-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-(1-ethylindol-7-yl)-2-methylpropan-2-ol
PubChem CID115115004
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name1-(1-ethylindol-7-yl)-2-methylpropan-2-ol
SMILESCCn1ccc2cccc(CC(C)(C)O)c21
InChIInChI=1S/C14H19NO/c1-4-15-9-8-11-6-5-7-12(13(11)15)10-14(2,3)16/h5-9,16H,4,10H2,1-3H3
InChIKeyBVMUBWKQZVJJEW-UHFFFAOYSA-N
XLogP2.97
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-1-(1-methylindol-7-yl)propan-2-ol
CID 115115003
1-(1-ethylindol-7-yl)propan-2-one
CID 115106501
4-[7-(aminomethyl)indol-1-yl]-2-methylbutan-2-ol
CID 102913373
3-(1-ethylindol-7-yl)-2-methylpropanoic acid
CID 115106604
4-[7-[(tert-butylamino)methyl]indol-1-yl]-2-methylbutan-2-ol
CID 102915153
2-(7-ethylindol-1-yl)acetic acid
CID 28602716
1-(7-chloro-1-ethylindol-3-yl)-2-methylpropan-2-ol
CID 117197676
1-(2,2-difluoro-2-phenylethyl)-7-ethylindole
CID 116790673
(1-ethylindol-7-yl) hypobromite
CID 23151410
1-(2-tert-butylsulfonylethyl)-7-ethylindole
CID 106731619
2-methyl-N-[[1-(2,2,2-trifluoroethyl)indol-7-yl]methyl]propan-2-amine
CID 102915151
1-(2-indol-1-ylphenyl)-2-methylpropan-2-ol
CID 70602665

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylindol-7-yl)-2-methylpropan-2-ol?
The IUPAC name of 1-(1-ethylindol-7-yl)-2-methylpropan-2-ol (CID 115115004) is 1-(1-ethylindol-7-yl)-2-methylpropan-2-ol.
What is the SMILES notation for 1-(1-ethylindol-7-yl)-2-methylpropan-2-ol?
The canonical SMILES for 1-(1-ethylindol-7-yl)-2-methylpropan-2-ol is CCn1ccc2cccc(CC(C)(C)O)c21.
What is the InChIKey of 1-(1-ethylindol-7-yl)-2-methylpropan-2-ol?
The InChIKey is BVMUBWKQZVJJEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-4-15-9-8-11-6-5-7-12(13(11)15)10-14(2,3)16/h5-9,16H,4,10H2,1-3H3.
What are the key properties of 1-(1-ethylindol-7-yl)-2-methylpropan-2-ol?
1-(1-ethylindol-7-yl)-2-methylpropan-2-ol has a molecular weight of 217.31 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylindol-7-yl)-2-methylpropan-2-ol is sourced from PubChem (CID 115115004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).