(1R)-1-(6-chloro-1H-indol-3-yl)ethanamine

C10H11ClN2 — CID 82759126

IUPAC(1R)-1-(6-chloro-1H-indol-3-yl)ethanamine
SMILESC[C@@H](N)c1c[nH]c2cc(Cl)ccc12
InChIInChI=1S/C10H11ClN2/c1-6(12)9-5-13-10-4-7(11)2-3-8(9)10/h2-6,13H,12H2,1H3/t6-/m1/s1
InChIKeyAVAQJCGKGNPZRK-ZCFIWIBFSA-N
MW194.66 g/mol
LogP2.84
Rot. Bonds1

About (1R)-1-(6-chloro-1H-indol-3-yl)ethanamine

(1R)-1-(6-chloro-1H-indol-3-yl)ethanamine (PubChem CID 82759126) has the molecular formula C10H11ClN2 and a molecular weight of 194.66 g/mol. Its IUPAC name is (1R)-1-(6-chloro-1H-indol-3-yl)ethanamine.

Molecular Properties

Compound Name(1R)-1-(6-chloro-1H-indol-3-yl)ethanamine
PubChem CID82759126
Molecular FormulaC10H11ClN2
Molecular Weight194.66 g/mol
Exact Mass194.06
IUPAC Name(1R)-1-(6-chloro-1H-indol-3-yl)ethanamine
SMILESC[C@@H](N)c1c[nH]c2cc(Cl)ccc12
InChIInChI=1S/C10H11ClN2/c1-6(12)9-5-13-10-4-7(11)2-3-8(9)10/h2-6,13H,12H2,1H3/t6-/m1/s1
InChIKeyAVAQJCGKGNPZRK-ZCFIWIBFSA-N
XLogP2.84
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.66
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

(1R)-1-(5-chloro-1H-indol-3-yl)ethanamine
CID 78961660
1-(5-chloro-1H-indol-3-yl)ethanamine
CID 3016992
(1S)-1-(6-methyl-1H-indol-3-yl)ethanamine
CID 82759015
2-amino-2-(6-chloro-1H-indol-3-yl)acetaldehyde
CID 88561394
(6-chloro-1H-indol-3-yl)-cyclobutylmethanamine
CID 82277722
3-[(1R)-1-aminoethyl]-1H-indole-6-carbonitrile
CID 107917700
(1S)-1-(6-nitro-1H-indol-3-yl)ethanamine
CID 82758109
3-[(2-bromophenyl)-(6-chloro-1H-indol-3-yl)methyl]-6-chloro-1H-indole
CID 171608072
1-(6-chloro-1H-indol-3-yl)-3-sulfanylpropane-1,2-diol
CID 170821278
6-chloro-1H-indole-3-carboxamide
CID 130666489
(1R)-1-(5-bromo-1H-indol-3-yl)ethanamine
CID 79018503
1-(5-chloro-1H-indol-3-yl)ethanol
CID 117195568

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(6-chloro-1H-indol-3-yl)ethanamine?
The IUPAC name of (1R)-1-(6-chloro-1H-indol-3-yl)ethanamine (CID 82759126) is (1R)-1-(6-chloro-1H-indol-3-yl)ethanamine.
What is the SMILES notation for (1R)-1-(6-chloro-1H-indol-3-yl)ethanamine?
The canonical SMILES for (1R)-1-(6-chloro-1H-indol-3-yl)ethanamine is C[C@@H](N)c1c[nH]c2cc(Cl)ccc12.
What is the InChIKey of (1R)-1-(6-chloro-1H-indol-3-yl)ethanamine?
The InChIKey is AVAQJCGKGNPZRK-ZCFIWIBFSA-N. The full InChI is InChI=1S/C10H11ClN2/c1-6(12)9-5-13-10-4-7(11)2-3-8(9)10/h2-6,13H,12H2,1H3/t6-/m1/s1.
What are the key properties of (1R)-1-(6-chloro-1H-indol-3-yl)ethanamine?
(1R)-1-(6-chloro-1H-indol-3-yl)ethanamine has a molecular weight of 194.66 g/mol, XLogP of 2.84, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(6-chloro-1H-indol-3-yl)ethanamine is sourced from PubChem (CID 82759126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).