(NZ)-N-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenylethylidene]hydroxylamine

C20H23NO3 — CID 57432829

IUPAC(NZ)-N-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenylethylidene]hydroxylamine
SMILESCOc1ccc(/C(Cc2ccccc2)=N\O)cc1OC1CCCC1
InChIInChI=1S/C20H23NO3/c1-23-19-12-11-16(14-20(19)24-17-9-5-6-10-17)18(21-22)13-15-7-3-2-4-8-15/h2-4,7-8,11-12,14,17,22H,5-6,9-10,13H2,1H3/b21-18-
InChIKeyJJJGROIGPJBFRR-UZYVYHOESA-N
MW325.41 g/mol
LogP4.44
Rot. Bonds6

About (NZ)-N-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenylethylidene]hydroxylamine

(NZ)-N-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenylethylidene]hydroxylamine (PubChem CID 57432829) has the molecular formula C20H23NO3 and a molecular weight of 325.41 g/mol. Its IUPAC name is (NZ)-N-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenylethylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenylethylidene]hydroxylamine
PubChem CID57432829
Molecular FormulaC20H23NO3
Molecular Weight325.41 g/mol
Exact Mass325.17
IUPAC Name(NZ)-N-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenylethylidene]hydroxylamine
SMILESCOc1ccc(/C(Cc2ccccc2)=N\O)cc1OC1CCCC1
InChIInChI=1S/C20H23NO3/c1-23-19-12-11-16(14-20(19)24-17-9-5-6-10-17)18(21-22)13-15-7-3-2-4-8-15/h2-4,7-8,11-12,14,17,22H,5-6,9-10,13H2,1H3/b21-18-
InChIKeyJJJGROIGPJBFRR-UZYVYHOESA-N
XLogP4.44
TPSA51.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

(NZ)-N-[2-chloro-1-(3-cyclopentyloxy-4-methoxyphenyl)ethylidene]hydroxylamine
CID 87638358
4-[(Z)-C-benzyl-N-hydroxycarbonimidoyl]-2-methoxyphenol
CID 136826320
(NE)-N-[1-(3-fluoro-4-methoxyphenyl)-2-phenylethylidene]hydroxylamine
CID 19608702
benzamide;3-cyclopentyloxy-4-methoxybenzamide
CID 18691056
[[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-(2,6-dichloro-4-pyridinyl)ethylidene]amino] carbamate
CID 173256484
2-[(3-cyclopentyloxy-4-methoxybenzoyl)amino]-3-phenylpropanoic acid
CID 120512153
2-[3-[(3-cyclopentyloxy-4-methoxybenzoyl)amino]phenyl]acetic acid
CID 120530673
3-[(E)-2-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenylethenyl]pyridazine
CID 19959374
2-amino-1-(3-cyclopentyloxy-4-methoxyphenyl)ethanone
CID 117376031
2-bromo-1-(3-cyclopentyloxy-4-methoxyphenyl)ethanone
CID 54438505
4-[(E)-2-(4-chlorophenyl)-1-phenylethenyl]-2-cyclopentyloxy-1-methoxybenzene
CID 70076005
(NE)-N-[1-(4-methoxyphenyl)-2-phenylethylidene]hydroxylamine
CID 10060245

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenylethylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenylethylidene]hydroxylamine (CID 57432829) is (NZ)-N-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenylethylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenylethylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenylethylidene]hydroxylamine is COc1ccc(/C(Cc2ccccc2)=N\O)cc1OC1CCCC1.
What is the InChIKey of (NZ)-N-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenylethylidene]hydroxylamine?
The InChIKey is JJJGROIGPJBFRR-UZYVYHOESA-N. The full InChI is InChI=1S/C20H23NO3/c1-23-19-12-11-16(14-20(19)24-17-9-5-6-10-17)18(21-22)13-15-7-3-2-4-8-15/h2-4,7-8,11-12,14,17,22H,5-6,9-10,13H2,1H3/b21-18-.
What are the key properties of (NZ)-N-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenylethylidene]hydroxylamine?
(NZ)-N-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenylethylidene]hydroxylamine has a molecular weight of 325.41 g/mol, XLogP of 4.44, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenylethylidene]hydroxylamine is sourced from PubChem (CID 57432829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).