2'-amino-5-hydroxyspiro[1H-indole-3,1'-cyclopropane]-2-one

C10H10N2O2 — CID 84719468

IUPAC2'-amino-5-hydroxyspiro[1H-indole-3,1'-cyclopropane]-2-one
SMILESNC1CC12C(=O)Nc1ccc(O)cc12
InChIInChI=1S/C10H10N2O2/c11-8-4-10(8)6-3-5(13)1-2-7(6)12-9(10)14/h1-3,8,13H,4,11H2,(H,12,14)
InChIKeyXDERBXMIZHVFBH-UHFFFAOYSA-N
MW190.20 g/mol
LogP0.31
Rot. Bonds

About 2'-amino-5-hydroxyspiro[1H-indole-3,1'-cyclopropane]-2-one

2'-amino-5-hydroxyspiro[1H-indole-3,1'-cyclopropane]-2-one (PubChem CID 84719468) has the molecular formula C10H10N2O2 and a molecular weight of 190.20 g/mol. Its IUPAC name is 2'-amino-5-hydroxyspiro[1H-indole-3,1'-cyclopropane]-2-one.

Molecular Properties

Compound Name2'-amino-5-hydroxyspiro[1H-indole-3,1'-cyclopropane]-2-one
PubChem CID84719468
Molecular FormulaC10H10N2O2
Molecular Weight190.20 g/mol
Exact Mass190.07
IUPAC Name2'-amino-5-hydroxyspiro[1H-indole-3,1'-cyclopropane]-2-one
SMILESNC1CC12C(=O)Nc1ccc(O)cc12
InChIInChI=1S/C10H10N2O2/c11-8-4-10(8)6-3-5(13)1-2-7(6)12-9(10)14/h1-3,8,13H,4,11H2,(H,12,14)
InChIKeyXDERBXMIZHVFBH-UHFFFAOYSA-N
XLogP0.31
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 50.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

2'-amino-6-methylspiro[1H-indole-3,1'-cyclopropane]-2-one
CID 84719127
2'-amino-6-methoxyspiro[1H-indole-3,1'-cyclopropane]-2-one
CID 84721821
(2'R,3R)-2'-(hydroxymethyl)-5-methylspiro[1H-indole-3,1'-cyclopropane]-2-one
CID 52915747
(2'S,3S)-2-oxo-2'-phenylspiro[1H-indole-3,1'-cyclopropane]-5-carboxylic acid
CID 99979078
(3R)-3-amino-7-hydroxy-3,4-dihydro-1H-quinolin-2-one
CID 86339030
(2'S,3R)-2'-(4-methylphenyl)-2-oxospiro[1H-indole-3,1'-cyclopropane]-5-carboxylic acid
CID 99979195
(2'S,3R)-2'-(hydroxymethyl)-5-(trifluoromethoxy)spiro[1H-indole-3,1'-cyclopropane]-2-one
CID 52915744
2'-butyl-5-chlorospiro[1H-indole-3,1'-cyclopropane]-2-one
CID 90935335
methyl 2-(5-bromo-2-oxospiro[1H-indole-3,2'-cyclopropane]-1'-yl)acetate
CID 15956437
(2'R,3S)-2'-(3-bromophenyl)-2-oxospiro[1H-indole-3,1'-cyclopropane]-5-carboxylic acid
CID 99979181
methyl 2-(6'-ethyl-5-hydroxy-2-oxospiro[1H-indole-3,1'-3,5,6,7,8,8a-hexahydro-2H-indolizine]-7'-yl)-3-methoxyprop-2-enoate
CID 162817789
4-amino-9-hydroxy-2,3,4,6-tetrahydro-1,6-benzoxazocin-5-one
CID 117246887

Frequently Asked Questions

What is the IUPAC name of 2'-amino-5-hydroxyspiro[1H-indole-3,1'-cyclopropane]-2-one?
The IUPAC name of 2'-amino-5-hydroxyspiro[1H-indole-3,1'-cyclopropane]-2-one (CID 84719468) is 2'-amino-5-hydroxyspiro[1H-indole-3,1'-cyclopropane]-2-one.
What is the SMILES notation for 2'-amino-5-hydroxyspiro[1H-indole-3,1'-cyclopropane]-2-one?
The canonical SMILES for 2'-amino-5-hydroxyspiro[1H-indole-3,1'-cyclopropane]-2-one is NC1CC12C(=O)Nc1ccc(O)cc12.
What is the InChIKey of 2'-amino-5-hydroxyspiro[1H-indole-3,1'-cyclopropane]-2-one?
The InChIKey is XDERBXMIZHVFBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2/c11-8-4-10(8)6-3-5(13)1-2-7(6)12-9(10)14/h1-3,8,13H,4,11H2,(H,12,14).
What are the key properties of 2'-amino-5-hydroxyspiro[1H-indole-3,1'-cyclopropane]-2-one?
2'-amino-5-hydroxyspiro[1H-indole-3,1'-cyclopropane]-2-one has a molecular weight of 190.20 g/mol, XLogP of 0.31, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2'-amino-5-hydroxyspiro[1H-indole-3,1'-cyclopropane]-2-one is sourced from PubChem (CID 84719468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).