N-[[3-(cyclopropylmethoxy)phenyl]methyl]hydroxylamine

C11H15NO2 — CID 117283837

IUPACN-[[3-(cyclopropylmethoxy)phenyl]methyl]hydroxylamine
SMILESONCc1cccc(OCC2CC2)c1
InChIInChI=1S/C11H15NO2/c13-12-7-10-2-1-3-11(6-10)14-8-9-4-5-9/h1-3,6,9,12-13H,4-5,7-8H2
InChIKeyVMUMZEWYQIEDLM-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.95
Rot. Bonds5

About N-[[3-(cyclopropylmethoxy)phenyl]methyl]hydroxylamine

N-[[3-(cyclopropylmethoxy)phenyl]methyl]hydroxylamine (PubChem CID 117283837) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is N-[[3-(cyclopropylmethoxy)phenyl]methyl]hydroxylamine.

Molecular Properties

Compound NameN-[[3-(cyclopropylmethoxy)phenyl]methyl]hydroxylamine
PubChem CID117283837
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC NameN-[[3-(cyclopropylmethoxy)phenyl]methyl]hydroxylamine
SMILESONCc1cccc(OCC2CC2)c1
InChIInChI=1S/C11H15NO2/c13-12-7-10-2-1-3-11(6-10)14-8-9-4-5-9/h1-3,6,9,12-13H,4-5,7-8H2
InChIKeyVMUMZEWYQIEDLM-UHFFFAOYSA-N
XLogP1.95
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[[3-(cyclopropylmethoxy)phenyl]methyl]-2-methoxyethanamine
CID 63055892
2-[3-(cyclopropylmethoxy)phenyl]acetic acid
CID 61398066
N-[[3-(cyclobutylmethoxy)phenyl]methyl]-2-methoxyethanamine
CID 65457089
1-(cyclohexylmethoxy)-3-ethylbenzene
CID 64765854
N-[[4-(cyclopropylmethoxy)-3-methoxyphenyl]methyl]hydroxylamine
CID 117319960
[3-(cyclopropylmethoxymethoxy)phenyl]methanol
CID 106929767
N-[[3-(oxetan-3-yloxy)phenyl]methyl]hydroxylamine
CID 83484577
2-[3-[(cyclopropylmethylamino)methyl]phenoxy]acetonitrile
CID 43756743
1-[2-[3-(cyclopropylmethoxy)phenyl]ethyl]cyclopropan-1-amine
CID 105490106
cyclopropylmethoxybenzene
CID 12712156
1-bromo-3-(cyclopropylmethoxy)benzene;ethane
CID 142361596
N-[[3-(difluoromethoxy)phenyl]methyl]hydroxylamine
CID 117281301

Frequently Asked Questions

What is the IUPAC name of N-[[3-(cyclopropylmethoxy)phenyl]methyl]hydroxylamine?
The IUPAC name of N-[[3-(cyclopropylmethoxy)phenyl]methyl]hydroxylamine (CID 117283837) is N-[[3-(cyclopropylmethoxy)phenyl]methyl]hydroxylamine.
What is the SMILES notation for N-[[3-(cyclopropylmethoxy)phenyl]methyl]hydroxylamine?
The canonical SMILES for N-[[3-(cyclopropylmethoxy)phenyl]methyl]hydroxylamine is ONCc1cccc(OCC2CC2)c1.
What is the InChIKey of N-[[3-(cyclopropylmethoxy)phenyl]methyl]hydroxylamine?
The InChIKey is VMUMZEWYQIEDLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c13-12-7-10-2-1-3-11(6-10)14-8-9-4-5-9/h1-3,6,9,12-13H,4-5,7-8H2.
What are the key properties of N-[[3-(cyclopropylmethoxy)phenyl]methyl]hydroxylamine?
N-[[3-(cyclopropylmethoxy)phenyl]methyl]hydroxylamine has a molecular weight of 193.25 g/mol, XLogP of 1.95, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(cyclopropylmethoxy)phenyl]methyl]hydroxylamine is sourced from PubChem (CID 117283837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).