2-amino-2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]indol-5-ol

C11H14N2O — CID 105444328

IUPAC2-amino-2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]indol-5-ol
SMILESNC1CC2Cc3c(O)cccc3N2C1
InChIInChI=1S/C11H14N2O/c12-7-4-8-5-9-10(13(8)6-7)2-1-3-11(9)14/h1-3,7-8,14H,4-6,12H2
InChIKeyPJTNIDGULJLCJB-UHFFFAOYSA-N
MW190.25 g/mol
LogP0.85
Rot. Bonds

About 2-amino-2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]indol-5-ol

2-amino-2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]indol-5-ol (PubChem CID 105444328) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 2-amino-2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]indol-5-ol.

Molecular Properties

Compound Name2-amino-2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]indol-5-ol
PubChem CID105444328
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name2-amino-2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]indol-5-ol
SMILESNC1CC2Cc3c(O)cccc3N2C1
InChIInChI=1S/C11H14N2O/c12-7-4-8-5-9-10(13(8)6-7)2-1-3-11(9)14/h1-3,7-8,14H,4-6,12H2
InChIKeyPJTNIDGULJLCJB-UHFFFAOYSA-N
XLogP0.85
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-methoxy-2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]indol-2-amine
CID 105456525
2-amino-2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]indol-7-ol
CID 105444334
6-methyl-2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]indol-2-amine
CID 105443276
2-amino-1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinolin-7-ol
CID 105456514
(1-fluoro-6,7,8,9,9a,10-hexahydropyrido[1,2-a]indol-8-yl)methanamine
CID 105475993
(1-chloro-6,7,8,9,9a,10-hexahydropyrido[1,2-a]indol-8-yl)methanamine
CID 105498590
1-cyclopentyl-3,4-dihydro-2H-quinolin-5-ol
CID 84735051
1-cyclohexyl-3,4-dihydro-2H-quinolin-5-ol
CID 84736247
2-(2-azabicyclo[2.2.1]heptan-2-yl)phenol
CID 84771208
(1S,2R)-2-amino-2,3-dihydro-1H-indene-1,4-diol
CID 95241574
(3R,5S)-1-(2,3-dihydro-1H-inden-2-yl)piperidine-3,5-diamine
CID 118550578
(3S)-1-hydroxy-3,4-dihydro-2H-quinolin-3-amine
CID 56971695

Frequently Asked Questions

What is the IUPAC name of 2-amino-2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]indol-5-ol?
The IUPAC name of 2-amino-2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]indol-5-ol (CID 105444328) is 2-amino-2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]indol-5-ol.
What is the SMILES notation for 2-amino-2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]indol-5-ol?
The canonical SMILES for 2-amino-2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]indol-5-ol is NC1CC2Cc3c(O)cccc3N2C1.
What is the InChIKey of 2-amino-2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]indol-5-ol?
The InChIKey is PJTNIDGULJLCJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c12-7-4-8-5-9-10(13(8)6-7)2-1-3-11(9)14/h1-3,7-8,14H,4-6,12H2.
What are the key properties of 2-amino-2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]indol-5-ol?
2-amino-2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]indol-5-ol has a molecular weight of 190.25 g/mol, XLogP of 0.85, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]indol-5-ol is sourced from PubChem (CID 105444328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).