carbamic acid;N-[2-(1H-indol-3-yl)ethyl]hydroxylamine

C11H15N3O3 — CID 158434815

IUPACcarbamic acid;N-[2-(1H-indol-3-yl)ethyl]hydroxylamine
SMILESNC(=O)O.ONCCc1c[nH]c2ccccc12
InChIInChI=1S/C10H12N2O.CH3NO2/c13-12-6-5-8-7-11-10-4-2-1-3-9(8)10;2-1(3)4/h1-4,7,11-13H,5-6H2;2H2,(H,3,4)
InChIKeyHCCFBAOUEASBJN-UHFFFAOYSA-N
MW237.26 g/mol
LogP1.31
Rot. Bonds3

About carbamic acid;N-[2-(1H-indol-3-yl)ethyl]hydroxylamine

carbamic acid;N-[2-(1H-indol-3-yl)ethyl]hydroxylamine (PubChem CID 158434815) has the molecular formula C11H15N3O3 and a molecular weight of 237.26 g/mol. Its IUPAC name is carbamic acid;N-[2-(1H-indol-3-yl)ethyl]hydroxylamine.

Molecular Properties

Compound Namecarbamic acid;N-[2-(1H-indol-3-yl)ethyl]hydroxylamine
PubChem CID158434815
Molecular FormulaC11H15N3O3
Molecular Weight237.26 g/mol
Exact Mass237.11
IUPAC Namecarbamic acid;N-[2-(1H-indol-3-yl)ethyl]hydroxylamine
SMILESNC(=O)O.ONCCc1c[nH]c2ccccc12
InChIInChI=1S/C10H12N2O.CH3NO2/c13-12-6-5-8-7-11-10-4-2-1-3-9(8)10;2-1(3)4/h1-4,7,11-13H,5-6H2;2H2,(H,3,4)
InChIKeyHCCFBAOUEASBJN-UHFFFAOYSA-N
XLogP1.31
TPSA111.37 Ų
H-Bond Donors5
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 51.31
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[carbamimidoyl(methyl)amino]acetic acid;N-[2-(1H-indol-3-yl)ethyl]hydroxylamine;sulfuric acid
CID 87550202
4-(1H-indol-3-yl)butanamide
CID 588715
1-N,4-N-bis[2-(1H-indol-3-yl)ethyl]benzene-1,4-dicarboxamide
CID 42988811
3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 10664257
N-benzyl-2-(1H-indol-3-yl)ethanamine;oxalic acid
CID 17367556
N-hydroxy-3-(1H-indol-3-yl)propanamide
CID 23938574
acetic acid;2-(1H-indol-3-yl)ethanamine
CID 57357905
1-(2-hydroxyethyl)-3-[2-(1H-indol-3-yl)ethyl]urea
CID 110894130
1-[2-(1H-indol-3-yl)ethylamino]propan-2-one
CID 91330877
(2S)-2-amino-N-[2-(1H-indol-3-yl)ethyl]propanamide;hydrochloride
CID 119263369
[2-(1H-indol-3-yl)ethylamino] acetate
CID 19864349
1-[2-(1H-indol-3-yl)ethyl]-2-methylguanidine
CID 86812869

Frequently Asked Questions

What is the IUPAC name of carbamic acid;N-[2-(1H-indol-3-yl)ethyl]hydroxylamine?
The IUPAC name of carbamic acid;N-[2-(1H-indol-3-yl)ethyl]hydroxylamine (CID 158434815) is carbamic acid;N-[2-(1H-indol-3-yl)ethyl]hydroxylamine.
What is the SMILES notation for carbamic acid;N-[2-(1H-indol-3-yl)ethyl]hydroxylamine?
The canonical SMILES for carbamic acid;N-[2-(1H-indol-3-yl)ethyl]hydroxylamine is NC(=O)O.ONCCc1c[nH]c2ccccc12.
What is the InChIKey of carbamic acid;N-[2-(1H-indol-3-yl)ethyl]hydroxylamine?
The InChIKey is HCCFBAOUEASBJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O.CH3NO2/c13-12-6-5-8-7-11-10-4-2-1-3-9(8)10;2-1(3)4/h1-4,7,11-13H,5-6H2;2H2,(H,3,4).
What are the key properties of carbamic acid;N-[2-(1H-indol-3-yl)ethyl]hydroxylamine?
carbamic acid;N-[2-(1H-indol-3-yl)ethyl]hydroxylamine has a molecular weight of 237.26 g/mol, XLogP of 1.31, 3 rotatable bonds, 5 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for carbamic acid;N-[2-(1H-indol-3-yl)ethyl]hydroxylamine is sourced from PubChem (CID 158434815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).