ethanol;5-nitroso-2,3-dihydro-1H-indole

C10H14N2O2 — CID 19098997

IUPACethanol;5-nitroso-2,3-dihydro-1H-indole
SMILESCCO.O=Nc1ccc2c(c1)CCN2
InChIInChI=1S/C8H8N2O.C2H6O/c11-10-7-1-2-8-6(5-7)3-4-9-8;1-2-3/h1-2,5,9H,3-4H2;3H,2H2,1H3
InChIKeyLOJCBTLZZASJDP-UHFFFAOYSA-N
MW194.23 g/mol
LogP2.05
Rot. Bonds1

About ethanol;5-nitroso-2,3-dihydro-1H-indole

ethanol;5-nitroso-2,3-dihydro-1H-indole (PubChem CID 19098997) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is ethanol;5-nitroso-2,3-dihydro-1H-indole.

Molecular Properties

Compound Nameethanol;5-nitroso-2,3-dihydro-1H-indole
PubChem CID19098997
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Nameethanol;5-nitroso-2,3-dihydro-1H-indole
SMILESCCO.O=Nc1ccc2c(c1)CCN2
InChIInChI=1S/C8H8N2O.C2H6O/c11-10-7-1-2-8-6(5-7)3-4-9-8;1-2-3/h1-2,5,9H,3-4H2;3H,2H2,1H3
InChIKeyLOJCBTLZZASJDP-UHFFFAOYSA-N
XLogP2.05
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-ethylsulfonyl-2,3-dihydro-1H-indole
CID 134176519
1-(2,3-dihydro-1H-indol-5-yl)ethanone
CID 170999934
1-(2,3-dihydro-1H-indol-5-yl)pentan-1-one
CID 39163742
methyl N-cyano-N'-(2,3-dihydro-1H-indol-5-yl)carbamimidothioate
CID 169363510
5-[(2-methylphenoxy)methyl]-2,3-dihydro-1H-indole
CID 115103966
N-(2,3-dihydro-1H-indol-5-yl)butanamide
CID 63253204
2-(benzylamino)-1-(2,3-dihydro-1H-indol-5-yl)butan-1-one
CID 82257869
1-(2,3-dihydro-1H-indol-5-yl)heptan-1-one
CID 116554189
3-(2,3-dihydro-1H-indol-5-yl)-1,1-diethylurea
CID 79161283
N-ethoxy-2,3-dihydro-1H-indole-5-carboxamide
CID 64974739
methyl 2-(2,3-dihydro-1H-indol-5-yl)acetate
CID 10888757
N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-ethylethanamine
CID 22898575

Frequently Asked Questions

What is the IUPAC name of ethanol;5-nitroso-2,3-dihydro-1H-indole?
The IUPAC name of ethanol;5-nitroso-2,3-dihydro-1H-indole (CID 19098997) is ethanol;5-nitroso-2,3-dihydro-1H-indole.
What is the SMILES notation for ethanol;5-nitroso-2,3-dihydro-1H-indole?
The canonical SMILES for ethanol;5-nitroso-2,3-dihydro-1H-indole is CCO.O=Nc1ccc2c(c1)CCN2.
What is the InChIKey of ethanol;5-nitroso-2,3-dihydro-1H-indole?
The InChIKey is LOJCBTLZZASJDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O.C2H6O/c11-10-7-1-2-8-6(5-7)3-4-9-8;1-2-3/h1-2,5,9H,3-4H2;3H,2H2,1H3.
What are the key properties of ethanol;5-nitroso-2,3-dihydro-1H-indole?
ethanol;5-nitroso-2,3-dihydro-1H-indole has a molecular weight of 194.23 g/mol, XLogP of 2.05, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethanol;5-nitroso-2,3-dihydro-1H-indole is sourced from PubChem (CID 19098997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).