N-(2-prop-1-enylphenyl)hydroxylamine

C9H11NO — CID 57180456

IUPACN-(2-prop-1-enylphenyl)hydroxylamine
SMILESCC=Cc1ccccc1NO
InChIInChI=1S/C9H11NO/c1-2-5-8-6-3-4-7-9(8)10-11/h2-7,10-11H,1H3
InChIKeyKMIHLYQOJZLEBW-UHFFFAOYSA-N
MW149.19 g/mol
LogP2.52
Rot. Bonds2

About N-(2-prop-1-enylphenyl)hydroxylamine

N-(2-prop-1-enylphenyl)hydroxylamine (PubChem CID 57180456) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is N-(2-prop-1-enylphenyl)hydroxylamine.

Molecular Properties

Compound NameN-(2-prop-1-enylphenyl)hydroxylamine
PubChem CID57180456
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC NameN-(2-prop-1-enylphenyl)hydroxylamine
SMILESCC=Cc1ccccc1NO
InChIInChI=1S/C9H11NO/c1-2-5-8-6-3-4-7-9(8)10-11/h2-7,10-11H,1H3
InChIKeyKMIHLYQOJZLEBW-UHFFFAOYSA-N
XLogP2.52
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[2-[(E)-prop-1-enyl]phenyl]hydrazine
CID 134447305
N-ethyl-2-[(Z)-prop-1-enyl]aniline
CID 145027913
ethane;(E)-3-[2-(hydroxyamino)phenyl]prop-2-enoic acid
CID 142952624
1-iodo-2-prop-1-enylbenzene
CID 54281188
N-[(2S)-but-3-en-2-yl]-2-[(E)-prop-1-enyl]aniline
CID 174245756
2-[[2-[(Z)-prop-1-enyl]phenyl]carbamoyl]benzoic acid
CID 138738575
N-(2-methanimidoylphenyl)hydroxylamine
CID 143516633
2,6-bis[(E)-prop-1-enyl]phenol
CID 21472692
ethane;1-methyl-2-[(Z)-prop-1-enyl]benzene
CID 145388668
(NE)-N-[[2-[(E)-prop-1-enyl]phenyl]methylidene]hydroxylamine
CID 15033296
1,5-bis(prop-1-enyl)naphthalene
CID 139669430
1,2,3-tris[(Z)-prop-1-enyl]benzene
CID 173113389

Frequently Asked Questions

What is the IUPAC name of N-(2-prop-1-enylphenyl)hydroxylamine?
The IUPAC name of N-(2-prop-1-enylphenyl)hydroxylamine (CID 57180456) is N-(2-prop-1-enylphenyl)hydroxylamine.
What is the SMILES notation for N-(2-prop-1-enylphenyl)hydroxylamine?
The canonical SMILES for N-(2-prop-1-enylphenyl)hydroxylamine is CC=Cc1ccccc1NO.
What is the InChIKey of N-(2-prop-1-enylphenyl)hydroxylamine?
The InChIKey is KMIHLYQOJZLEBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c1-2-5-8-6-3-4-7-9(8)10-11/h2-7,10-11H,1H3.
What are the key properties of N-(2-prop-1-enylphenyl)hydroxylamine?
N-(2-prop-1-enylphenyl)hydroxylamine has a molecular weight of 149.19 g/mol, XLogP of 2.52, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-prop-1-enylphenyl)hydroxylamine is sourced from PubChem (CID 57180456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).