(3R)-3-amino-3-(2,3-dihydro-1H-indol-7-yl)propan-1-ol

C11H16N2O — CID 55264438

IUPAC(3R)-3-amino-3-(2,3-dihydro-1H-indol-7-yl)propan-1-ol
SMILESN[C@H](CCO)c1cccc2c1NCC2
InChIInChI=1S/C11H16N2O/c12-10(5-7-14)9-3-1-2-8-4-6-13-11(8)9/h1-3,10,13-14H,4-7,12H2/t10-/m1/s1
InChIKeyGBJBYYYBHUAFKK-SNVBAGLBSA-N
MW192.26 g/mol
LogP1.04
Rot. Bonds3

About (3R)-3-amino-3-(2,3-dihydro-1H-indol-7-yl)propan-1-ol

(3R)-3-amino-3-(2,3-dihydro-1H-indol-7-yl)propan-1-ol (PubChem CID 55264438) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is (3R)-3-amino-3-(2,3-dihydro-1H-indol-7-yl)propan-1-ol.

Molecular Properties

Compound Name(3R)-3-amino-3-(2,3-dihydro-1H-indol-7-yl)propan-1-ol
PubChem CID55264438
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name(3R)-3-amino-3-(2,3-dihydro-1H-indol-7-yl)propan-1-ol
SMILESN[C@H](CCO)c1cccc2c1NCC2
InChIInChI=1S/C11H16N2O/c12-10(5-7-14)9-3-1-2-8-4-6-13-11(8)9/h1-3,10,13-14H,4-7,12H2/t10-/m1/s1
InChIKeyGBJBYYYBHUAFKK-SNVBAGLBSA-N
XLogP1.04
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-2-(2,3-dihydro-1H-indol-7-yl)ethanol
CID 55278047
(3S)-3-amino-3-(2,3-dihydro-1H-indol-7-yl)propanenitrile
CID 130606548
(2S)-2-(2,3-dihydro-1H-indol-7-yl)-2-(methylamino)ethanol
CID 55277545
3-amino-3-(2,3-dihydro-1H-indol-5-yl)propan-1-ol
CID 55297643
3-amino-3-(2,2-dimethyl-3,4-dihydrochromen-8-yl)propan-1-ol
CID 84698811
2-(1-amino-3-hydroxypropyl)phenol;hydrochloride
CID 170874374
7-(1-fluoro-2-pyridin-4-ylethyl)-2,3-dihydro-1H-indole
CID 113394346
(3S)-3-amino-3-(2,3-dibromophenyl)propan-1-ol
CID 130664899
7-[2-(5-chloro-2-fluorophenyl)-1-fluoroethyl]-2,3-dihydro-1H-indole
CID 103052163
(3S)-3-amino-3-(2,3-difluorophenyl)propan-1-ol;hydrochloride
CID 171223730
7-[(3-bromo-2-fluorophenyl)-fluoromethyl]-2,3-dihydro-1H-indole
CID 106647083
7-[fluoro(pyrimidin-5-yl)methyl]-2,3-dihydro-1H-indole
CID 113394357

Frequently Asked Questions

What is the IUPAC name of (3R)-3-amino-3-(2,3-dihydro-1H-indol-7-yl)propan-1-ol?
The IUPAC name of (3R)-3-amino-3-(2,3-dihydro-1H-indol-7-yl)propan-1-ol (CID 55264438) is (3R)-3-amino-3-(2,3-dihydro-1H-indol-7-yl)propan-1-ol.
What is the SMILES notation for (3R)-3-amino-3-(2,3-dihydro-1H-indol-7-yl)propan-1-ol?
The canonical SMILES for (3R)-3-amino-3-(2,3-dihydro-1H-indol-7-yl)propan-1-ol is N[C@H](CCO)c1cccc2c1NCC2.
What is the InChIKey of (3R)-3-amino-3-(2,3-dihydro-1H-indol-7-yl)propan-1-ol?
The InChIKey is GBJBYYYBHUAFKK-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H16N2O/c12-10(5-7-14)9-3-1-2-8-4-6-13-11(8)9/h1-3,10,13-14H,4-7,12H2/t10-/m1/s1.
What are the key properties of (3R)-3-amino-3-(2,3-dihydro-1H-indol-7-yl)propan-1-ol?
(3R)-3-amino-3-(2,3-dihydro-1H-indol-7-yl)propan-1-ol has a molecular weight of 192.26 g/mol, XLogP of 1.04, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-amino-3-(2,3-dihydro-1H-indol-7-yl)propan-1-ol is sourced from PubChem (CID 55264438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).