(NE)-N-[1-(2-cyclopentyloxyphenyl)propylidene]hydroxylamine

C14H19NO2 — CID 43185539

IUPAC(NE)-N-[1-(2-cyclopentyloxyphenyl)propylidene]hydroxylamine
SMILESCC/C(=N\O)c1ccccc1OC1CCCC1
InChIInChI=1S/C14H19NO2/c1-2-13(15-16)12-9-5-6-10-14(12)17-11-7-3-4-8-11/h5-6,9-11,16H,2-4,7-8H2,1H3/b15-13+
InChIKeyRWDZORKYPCNRQL-FYWRMAATSA-N
MW233.31 g/mol
LogP3.60
Rot. Bonds4

About (NE)-N-[1-(2-cyclopentyloxyphenyl)propylidene]hydroxylamine

(NE)-N-[1-(2-cyclopentyloxyphenyl)propylidene]hydroxylamine (PubChem CID 43185539) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is (NE)-N-[1-(2-cyclopentyloxyphenyl)propylidene]hydroxylamine.

Molecular Properties

Compound Name(NE)-N-[1-(2-cyclopentyloxyphenyl)propylidene]hydroxylamine
PubChem CID43185539
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name(NE)-N-[1-(2-cyclopentyloxyphenyl)propylidene]hydroxylamine
SMILESCC/C(=N\O)c1ccccc1OC1CCCC1
InChIInChI=1S/C14H19NO2/c1-2-13(15-16)12-9-5-6-10-14(12)17-11-7-3-4-8-11/h5-6,9-11,16H,2-4,7-8H2,1H3/b15-13+
InChIKeyRWDZORKYPCNRQL-FYWRMAATSA-N
XLogP3.60
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-[2-[(E)-C-ethyl-N-hydroxycarbonimidoyl]phenoxy]-1,1-dioxothiolan-3-ol
CID 60884883
methyl 2-cyclohexyloxybenzoate
CID 11345342
1,2-dicyclohexyloxybenzene
CID 67331328
(NE)-N-[1-[2-(2-chloroprop-2-enoxy)phenyl]propylidene]hydroxylamine
CID 43823257
3-amino-1-(2-cyclobutyloxyphenyl)propan-1-one
CID 117312431
1-(2-cyclopentyloxyphenyl)propan-1-ol
CID 43503588
(NE)-N-[1-[2-[2-(diethylamino)ethoxy]phenyl]propylidene]hydroxylamine
CID 43185548
3-[2-[(Z)-C-ethyl-N-hydroxycarbonimidoyl]phenoxy]propane-1,2-diol
CID 82849492
N-[1-[2-[3-(2,2,2-trifluoroethoxy)propoxy]phenyl]propylidene]hydroxylamine
CID 76905202
2-[2-[(E)-C-ethyl-N-hydroxycarbonimidoyl]phenoxy]-N,N-dimethylacetamide
CID 24704040
N-[(2-cyclohexyloxyphenyl)methyl]ethanamine
CID 43277237
(NZ)-N-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenylethylidene]hydroxylamine
CID 57432829

Frequently Asked Questions

What is the IUPAC name of (NE)-N-[1-(2-cyclopentyloxyphenyl)propylidene]hydroxylamine?
The IUPAC name of (NE)-N-[1-(2-cyclopentyloxyphenyl)propylidene]hydroxylamine (CID 43185539) is (NE)-N-[1-(2-cyclopentyloxyphenyl)propylidene]hydroxylamine.
What is the SMILES notation for (NE)-N-[1-(2-cyclopentyloxyphenyl)propylidene]hydroxylamine?
The canonical SMILES for (NE)-N-[1-(2-cyclopentyloxyphenyl)propylidene]hydroxylamine is CC/C(=N\O)c1ccccc1OC1CCCC1.
What is the InChIKey of (NE)-N-[1-(2-cyclopentyloxyphenyl)propylidene]hydroxylamine?
The InChIKey is RWDZORKYPCNRQL-FYWRMAATSA-N. The full InChI is InChI=1S/C14H19NO2/c1-2-13(15-16)12-9-5-6-10-14(12)17-11-7-3-4-8-11/h5-6,9-11,16H,2-4,7-8H2,1H3/b15-13+.
What are the key properties of (NE)-N-[1-(2-cyclopentyloxyphenyl)propylidene]hydroxylamine?
(NE)-N-[1-(2-cyclopentyloxyphenyl)propylidene]hydroxylamine has a molecular weight of 233.31 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (NE)-N-[1-(2-cyclopentyloxyphenyl)propylidene]hydroxylamine is sourced from PubChem (CID 43185539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).