2-amino-2-(7-chloro-1H-indol-5-yl)ethanol

C10H11ClN2O — CID 83885288

IUPAC2-amino-2-(7-chloro-1H-indol-5-yl)ethanol
SMILESNC(CO)c1cc(Cl)c2[nH]ccc2c1
InChIInChI=1S/C10H11ClN2O/c11-8-4-7(9(12)5-14)3-6-1-2-13-10(6)8/h1-4,9,13-14H,5,12H2
InChIKeyKIVXEOHPOWXNKV-UHFFFAOYSA-N
MW210.66 g/mol
LogP1.81
Rot. Bonds2

About 2-amino-2-(7-chloro-1H-indol-5-yl)ethanol

2-amino-2-(7-chloro-1H-indol-5-yl)ethanol (PubChem CID 83885288) has the molecular formula C10H11ClN2O and a molecular weight of 210.66 g/mol. Its IUPAC name is 2-amino-2-(7-chloro-1H-indol-5-yl)ethanol.

Molecular Properties

Compound Name2-amino-2-(7-chloro-1H-indol-5-yl)ethanol
PubChem CID83885288
Molecular FormulaC10H11ClN2O
Molecular Weight210.66 g/mol
Exact Mass210.06
IUPAC Name2-amino-2-(7-chloro-1H-indol-5-yl)ethanol
SMILESNC(CO)c1cc(Cl)c2[nH]ccc2c1
InChIInChI=1S/C10H11ClN2O/c11-8-4-7(9(12)5-14)3-6-1-2-13-10(6)8/h1-4,9,13-14H,5,12H2
InChIKeyKIVXEOHPOWXNKV-UHFFFAOYSA-N
XLogP1.81
TPSA62.04 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.66
LogP ≤ 51.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(1S)-1-amino-2-hydroxyethyl]-2-chlorophenol
CID 55277962
(2S)-2-amino-2-(3,4-dichlorophenyl)ethanol;hydrochloride
CID 74889971
(2R)-2-amino-2-(2,6-dichloro-4-pyridinyl)ethanol
CID 130624818
2-amino-2-(5,7-difluoro-1H-indol-6-yl)ethanol
CID 117302615
2-amino-2-(3-chloro-4-fluorophenyl)ethanol
CID 3564183
2-amino-2-(4-bromo-3-chlorophenyl)ethanol
CID 77130463
2-(7-chloro-1H-indol-5-yl)ethanimidamide
CID 83883547
(2S)-2-amino-2-(7-chloro-1,3-benzodioxol-5-yl)ethanol
CID 93471728
2-amino-2-(7-chloro-1H-indol-2-yl)ethanol
CID 82612595
acetic acid;5,7-dichloro-1H-indole
CID 162328874
2-(7-chloro-1H-indol-5-yl)acetaldehyde
CID 83878658
2-amino-2-(3-bromo-5-chloro-4-fluorophenyl)ethanol
CID 117424956

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(7-chloro-1H-indol-5-yl)ethanol?
The IUPAC name of 2-amino-2-(7-chloro-1H-indol-5-yl)ethanol (CID 83885288) is 2-amino-2-(7-chloro-1H-indol-5-yl)ethanol.
What is the SMILES notation for 2-amino-2-(7-chloro-1H-indol-5-yl)ethanol?
The canonical SMILES for 2-amino-2-(7-chloro-1H-indol-5-yl)ethanol is NC(CO)c1cc(Cl)c2[nH]ccc2c1.
What is the InChIKey of 2-amino-2-(7-chloro-1H-indol-5-yl)ethanol?
The InChIKey is KIVXEOHPOWXNKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN2O/c11-8-4-7(9(12)5-14)3-6-1-2-13-10(6)8/h1-4,9,13-14H,5,12H2.
What are the key properties of 2-amino-2-(7-chloro-1H-indol-5-yl)ethanol?
2-amino-2-(7-chloro-1H-indol-5-yl)ethanol has a molecular weight of 210.66 g/mol, XLogP of 1.81, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(7-chloro-1H-indol-5-yl)ethanol is sourced from PubChem (CID 83885288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).