(NZ)-N-[1-[2-(3-pyrrolidin-1-ylpropoxy)phenyl]ethylidene]hydroxylamine

C15H22N2O2 — CID 109374436

IUPAC(NZ)-N-[1-[2-(3-pyrrolidin-1-ylpropoxy)phenyl]ethylidene]hydroxylamine
SMILESC/C(=N/O)c1ccccc1OCCCN1CCCC1
InChIInChI=1S/C15H22N2O2/c1-13(16-18)14-7-2-3-8-15(14)19-12-6-11-17-9-4-5-10-17/h2-3,7-8,18H,4-6,9-12H2,1H3/b16-13-
InChIKeyXTQOYLANIUYOHB-SSZFMOIBSA-N
MW262.35 g/mol
LogP2.75
Rot. Bonds6

About (NZ)-N-[1-[2-(3-pyrrolidin-1-ylpropoxy)phenyl]ethylidene]hydroxylamine

(NZ)-N-[1-[2-(3-pyrrolidin-1-ylpropoxy)phenyl]ethylidene]hydroxylamine (PubChem CID 109374436) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is (NZ)-N-[1-[2-(3-pyrrolidin-1-ylpropoxy)phenyl]ethylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[1-[2-(3-pyrrolidin-1-ylpropoxy)phenyl]ethylidene]hydroxylamine
PubChem CID109374436
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name(NZ)-N-[1-[2-(3-pyrrolidin-1-ylpropoxy)phenyl]ethylidene]hydroxylamine
SMILESC/C(=N/O)c1ccccc1OCCCN1CCCC1
InChIInChI=1S/C15H22N2O2/c1-13(16-18)14-7-2-3-8-15(14)19-12-6-11-17-9-4-5-10-17/h2-3,7-8,18H,4-6,9-12H2,1H3/b16-13-
InChIKeyXTQOYLANIUYOHB-SSZFMOIBSA-N
XLogP2.75
TPSA45.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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

(NE)-N-[1-(2-octoxyphenyl)ethylidene]hydroxylamine
CID 43129538
N-[1-(2-decoxyphenyl)ethylidene]hydroxylamine
CID 76999545
1-[2-[2-[(Z)-N-hydroxy-C-methylcarbonimidoyl]phenoxy]ethyl]pyridin-2-one
CID 82897410
1-[2-[6-(aziridin-1-yl)hexoxy]phenyl]ethanone
CID 167050597
1-[2-(3-piperidin-1-ylpropoxy)phenyl]propan-2-one
CID 142037946
1-[3-(2-ethylphenoxy)propyl]pyrrolidine
CID 2262767
(1R)-1-[2-(3-pyrrolidin-1-ylpropoxy)phenyl]ethanol
CID 63364786
1-[3-(2-chlorophenoxy)propyl]piperidine
CID 2058914
N-[1-[2-(2-phenylsulfanylethoxy)phenyl]ethylidene]hydroxylamine
CID 79221819
1,2-bis[2-[2-(azocan-1-yl)ethoxy]phenyl]ethane-1,2-dione
CID 21486308
1-[3-(2-bromophenoxy)propyl]azepane
CID 2195329
2-[2-(3-pyrrolidin-1-ylpropoxy)phenyl]acetic acid
CID 11108172

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[1-[2-(3-pyrrolidin-1-ylpropoxy)phenyl]ethylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[1-[2-(3-pyrrolidin-1-ylpropoxy)phenyl]ethylidene]hydroxylamine (CID 109374436) is (NZ)-N-[1-[2-(3-pyrrolidin-1-ylpropoxy)phenyl]ethylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[1-[2-(3-pyrrolidin-1-ylpropoxy)phenyl]ethylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[1-[2-(3-pyrrolidin-1-ylpropoxy)phenyl]ethylidene]hydroxylamine is C/C(=N/O)c1ccccc1OCCCN1CCCC1.
What is the InChIKey of (NZ)-N-[1-[2-(3-pyrrolidin-1-ylpropoxy)phenyl]ethylidene]hydroxylamine?
The InChIKey is XTQOYLANIUYOHB-SSZFMOIBSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-13(16-18)14-7-2-3-8-15(14)19-12-6-11-17-9-4-5-10-17/h2-3,7-8,18H,4-6,9-12H2,1H3/b16-13-.
What are the key properties of (NZ)-N-[1-[2-(3-pyrrolidin-1-ylpropoxy)phenyl]ethylidene]hydroxylamine?
(NZ)-N-[1-[2-(3-pyrrolidin-1-ylpropoxy)phenyl]ethylidene]hydroxylamine has a molecular weight of 262.35 g/mol, XLogP of 2.75, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[1-[2-(3-pyrrolidin-1-ylpropoxy)phenyl]ethylidene]hydroxylamine is sourced from PubChem (CID 109374436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).