(1R)-1-amino-6-hydroxy-2,3-dihydro-1H-indene-5-carbonitrile

C10H10N2O — CID 131123798

IUPAC(1R)-1-amino-6-hydroxy-2,3-dihydro-1H-indene-5-carbonitrile
SMILESN#Cc1cc2c(cc1O)[C@H](N)CC2
InChIInChI=1S/C10H10N2O/c11-5-7-3-6-1-2-9(12)8(6)4-10(7)13/h3-4,9,13H,1-2,12H2/t9-/m1/s1
InChIKeyRBHVNVZYSMJJOX-SECBINFHSA-N
MW174.20 g/mol
LogP1.21
Rot. Bonds

About (1R)-1-amino-6-hydroxy-2,3-dihydro-1H-indene-5-carbonitrile

(1R)-1-amino-6-hydroxy-2,3-dihydro-1H-indene-5-carbonitrile (PubChem CID 131123798) has the molecular formula C10H10N2O and a molecular weight of 174.20 g/mol. Its IUPAC name is (1R)-1-amino-6-hydroxy-2,3-dihydro-1H-indene-5-carbonitrile.

Molecular Properties

Compound Name(1R)-1-amino-6-hydroxy-2,3-dihydro-1H-indene-5-carbonitrile
PubChem CID131123798
Molecular FormulaC10H10N2O
Molecular Weight174.20 g/mol
Exact Mass174.08
IUPAC Name(1R)-1-amino-6-hydroxy-2,3-dihydro-1H-indene-5-carbonitrile
SMILESN#Cc1cc2c(cc1O)[C@H](N)CC2
InChIInChI=1S/C10H10N2O/c11-5-7-3-6-1-2-9(12)8(6)4-10(7)13/h3-4,9,13H,1-2,12H2/t9-/m1/s1
InChIKeyRBHVNVZYSMJJOX-SECBINFHSA-N
XLogP1.21
TPSA70.04 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-amino-6-hydroxy-2,3-dihydro-1H-indene-5-carbonitrile?
The IUPAC name of (1R)-1-amino-6-hydroxy-2,3-dihydro-1H-indene-5-carbonitrile (CID 131123798) is (1R)-1-amino-6-hydroxy-2,3-dihydro-1H-indene-5-carbonitrile.
What is the SMILES notation for (1R)-1-amino-6-hydroxy-2,3-dihydro-1H-indene-5-carbonitrile?
The canonical SMILES for (1R)-1-amino-6-hydroxy-2,3-dihydro-1H-indene-5-carbonitrile is N#Cc1cc2c(cc1O)[C@H](N)CC2.
What is the InChIKey of (1R)-1-amino-6-hydroxy-2,3-dihydro-1H-indene-5-carbonitrile?
The InChIKey is RBHVNVZYSMJJOX-SECBINFHSA-N. The full InChI is InChI=1S/C10H10N2O/c11-5-7-3-6-1-2-9(12)8(6)4-10(7)13/h3-4,9,13H,1-2,12H2/t9-/m1/s1.
What are the key properties of (1R)-1-amino-6-hydroxy-2,3-dihydro-1H-indene-5-carbonitrile?
(1R)-1-amino-6-hydroxy-2,3-dihydro-1H-indene-5-carbonitrile has a molecular weight of 174.20 g/mol, XLogP of 1.21, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-amino-6-hydroxy-2,3-dihydro-1H-indene-5-carbonitrile is sourced from PubChem (CID 131123798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).