(NZ)-N-[2-phenyl-1-(1-pyridin-4-yl-3,5-dihydrocyclopenta[f]isoindol-6-yl)ethylidene]hydroxylamine

C24H19N3O — CID 172957272

IUPAC(NZ)-N-[2-phenyl-1-(1-pyridin-4-yl-3,5-dihydrocyclopenta[f]isoindol-6-yl)ethylidene]hydroxylamine
SMILESO/N=C(/Cc1ccccc1)C1=Cc2cc3c(cc2C1)CN=C3c1ccncc1
InChIInChI=1S/C24H19N3O/c28-27-23(10-16-4-2-1-3-5-16)20-11-18-13-21-15-26-24(17-6-8-25-9-7-17)22(21)14-19(18)12-20/h1-9,12-14,28H,10-11,15H2/b27-23-
InChIKeyWXJAQKRBGJLRNR-VYIQYICTSA-N
MW365.44 g/mol
LogP4.45
Rot. Bonds4

About (NZ)-N-[2-phenyl-1-(1-pyridin-4-yl-3,5-dihydrocyclopenta[f]isoindol-6-yl)ethylidene]hydroxylamine

(NZ)-N-[2-phenyl-1-(1-pyridin-4-yl-3,5-dihydrocyclopenta[f]isoindol-6-yl)ethylidene]hydroxylamine (PubChem CID 172957272) has the molecular formula C24H19N3O and a molecular weight of 365.44 g/mol. Its IUPAC name is (NZ)-N-[2-phenyl-1-(1-pyridin-4-yl-3,5-dihydrocyclopenta[f]isoindol-6-yl)ethylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[2-phenyl-1-(1-pyridin-4-yl-3,5-dihydrocyclopenta[f]isoindol-6-yl)ethylidene]hydroxylamine
PubChem CID172957272
Molecular FormulaC24H19N3O
Molecular Weight365.44 g/mol
Exact Mass365.15
IUPAC Name(NZ)-N-[2-phenyl-1-(1-pyridin-4-yl-3,5-dihydrocyclopenta[f]isoindol-6-yl)ethylidene]hydroxylamine
SMILESO/N=C(/Cc1ccccc1)C1=Cc2cc3c(cc2C1)CN=C3c1ccncc1
InChIInChI=1S/C24H19N3O/c28-27-23(10-16-4-2-1-3-5-16)20-11-18-13-21-15-26-24(17-6-8-25-9-7-17)22(21)14-19(18)12-20/h1-9,12-14,28H,10-11,15H2/b27-23-
InChIKeyWXJAQKRBGJLRNR-VYIQYICTSA-N
XLogP4.45
TPSA57.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.44
LogP ≤ 54.45
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

benzyl-oxo-(7-pyridin-4-yl-3,5-dihydropyrrolo[3,4-f]indol-2-yl)phosphanium
CID 159538962
4-benzyl-7-pyridin-4-yl-3,4,5,9-tetrahydropyrrolo[3,4-h][1,3]benzoxazepin-2-one
CID 159269622
6-(1-phenylethyl)-3-pyridin-3-yl-1,8-dihydrobenzo[f]isoindol-7-one
CID 159288470
2-(6-methyl-2-pyridinyl)-1-(7-pyridin-4-yl-3,5-dihydropyrrolo[3,4-f]indol-2-yl)ethanone
CID 158243670
7-pyridin-4-yl-N-[(1R)-1-pyridin-2-ylethyl]-3,5-dihydropyrrolo[3,4-f]indole-2-carboxamide
CID 157296115
11-benzyl-6-pyridin-4-yl-12-oxa-2,5-diazatricyclo[7.5.0.03,7]tetradeca-1,3(7),5,8-tetraen-13-one
CID 159269623
(NZ)-N-[2-phenyl-1-(4-phenylphenyl)ethylidene]hydroxylamine
CID 6381176
2-(3-chloro-4-fluorophenyl)-1-[1-(oxan-4-yl)-3,5-dihydrocyclopenta[f]isoindol-6-yl]ethanone
CID 159718626
(NZ)-N-[1-(4-fluorophenyl)-2-phenylethylidene]hydroxylamine
CID 22277781
8-benzyl-1-(2-methyl-4-pyridinyl)-3,5,8,9-tetrahydrooxepino[4,5-f]isoindol-6-one
CID 158986052
3-(2-methyl-3-pyridinyl)-6-(1-phenylethyl)-1,8-dihydrobenzo[f]isoindol-7-one
CID 159389860
(4E)-4-hydroxyimino-5-phenylpentanoic acid
CID 6341274

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[2-phenyl-1-(1-pyridin-4-yl-3,5-dihydrocyclopenta[f]isoindol-6-yl)ethylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[2-phenyl-1-(1-pyridin-4-yl-3,5-dihydrocyclopenta[f]isoindol-6-yl)ethylidene]hydroxylamine (CID 172957272) is (NZ)-N-[2-phenyl-1-(1-pyridin-4-yl-3,5-dihydrocyclopenta[f]isoindol-6-yl)ethylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[2-phenyl-1-(1-pyridin-4-yl-3,5-dihydrocyclopenta[f]isoindol-6-yl)ethylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[2-phenyl-1-(1-pyridin-4-yl-3,5-dihydrocyclopenta[f]isoindol-6-yl)ethylidene]hydroxylamine is O/N=C(/Cc1ccccc1)C1=Cc2cc3c(cc2C1)CN=C3c1ccncc1.
What is the InChIKey of (NZ)-N-[2-phenyl-1-(1-pyridin-4-yl-3,5-dihydrocyclopenta[f]isoindol-6-yl)ethylidene]hydroxylamine?
The InChIKey is WXJAQKRBGJLRNR-VYIQYICTSA-N. The full InChI is InChI=1S/C24H19N3O/c28-27-23(10-16-4-2-1-3-5-16)20-11-18-13-21-15-26-24(17-6-8-25-9-7-17)22(21)14-19(18)12-20/h1-9,12-14,28H,10-11,15H2/b27-23-.
What are the key properties of (NZ)-N-[2-phenyl-1-(1-pyridin-4-yl-3,5-dihydrocyclopenta[f]isoindol-6-yl)ethylidene]hydroxylamine?
(NZ)-N-[2-phenyl-1-(1-pyridin-4-yl-3,5-dihydrocyclopenta[f]isoindol-6-yl)ethylidene]hydroxylamine has a molecular weight of 365.44 g/mol, XLogP of 4.45, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[2-phenyl-1-(1-pyridin-4-yl-3,5-dihydrocyclopenta[f]isoindol-6-yl)ethylidene]hydroxylamine is sourced from PubChem (CID 172957272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).