(NZ)-N-[3-(1-benzylpiperidin-4-yl)-1-(4-pyrrolidin-1-ylphenyl)propylidene]hydroxylamine

C25H33N3O — CID 19390888

IUPAC(NZ)-N-[3-(1-benzylpiperidin-4-yl)-1-(4-pyrrolidin-1-ylphenyl)propylidene]hydroxylamine
SMILESO/N=C(/CCC1CCN(Cc2ccccc2)CC1)c1ccc(N2CCCC2)cc1
InChIInChI=1S/C25H33N3O/c29-26-25(23-9-11-24(12-10-23)28-16-4-5-17-28)13-8-21-14-18-27(19-15-21)20-22-6-2-1-3-7-22/h1-3,6-7,9-12,21,29H,4-5,8,13-20H2/b26-25-
InChIKeyFWFNCAKKCRJCTP-QPLCGJKRSA-N
MW391.56 g/mol
LogP5.16
Rot. Bonds7

About (NZ)-N-[3-(1-benzylpiperidin-4-yl)-1-(4-pyrrolidin-1-ylphenyl)propylidene]hydroxylamine

(NZ)-N-[3-(1-benzylpiperidin-4-yl)-1-(4-pyrrolidin-1-ylphenyl)propylidene]hydroxylamine (PubChem CID 19390888) has the molecular formula C25H33N3O and a molecular weight of 391.56 g/mol. Its IUPAC name is (NZ)-N-[3-(1-benzylpiperidin-4-yl)-1-(4-pyrrolidin-1-ylphenyl)propylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[3-(1-benzylpiperidin-4-yl)-1-(4-pyrrolidin-1-ylphenyl)propylidene]hydroxylamine
PubChem CID19390888
Molecular FormulaC25H33N3O
Molecular Weight391.56 g/mol
Exact Mass391.26
IUPAC Name(NZ)-N-[3-(1-benzylpiperidin-4-yl)-1-(4-pyrrolidin-1-ylphenyl)propylidene]hydroxylamine
SMILESO/N=C(/CCC1CCN(Cc2ccccc2)CC1)c1ccc(N2CCCC2)cc1
InChIInChI=1S/C25H33N3O/c29-26-25(23-9-11-24(12-10-23)28-16-4-5-17-28)13-8-21-14-18-27(19-15-21)20-22-6-2-1-3-7-22/h1-3,6-7,9-12,21,29H,4-5,8,13-20H2/b26-25-
InChIKeyFWFNCAKKCRJCTP-QPLCGJKRSA-N
XLogP5.16
TPSA39.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500391.56
LogP ≤ 55.16
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'}

Analyze (NZ)-N-[3-(1-benzylpiperidin-4-yl)-1-(4-pyrrolidin-1-ylphenyl)propylidene]hydroxylamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(1-benzylpiperidin-4-yl)-1-(4-pyrrolidin-1-ylphenyl)ethanone
CID 10406365
4-(1-benzylpiperidin-4-yl)-N'-hydroxybutanimidamide
CID 86750726
3-(1-benzylazepan-4-yl)propanoic acid
CID 82624039
3-[2-(1-benzylpiperidin-4-yl)ethyl]-6-piperidin-1-yl-1,2-benzoxazole
CID 18377514
3-(1-benzylpiperidin-4-yl)-1-(1-phenyl-3,4-dihydro-2H-quinolin-6-yl)propan-1-one
CID 46889354
2-(1-benzylpiperidin-4-yl)ethanamine;dihydrochloride
CID 17221509
4-(4-benzylpiperidin-1-yl)benzoic acid
CID 22730857
1-benzyl-5-hydroxyazepane-4-carboxylic acid
CID 83488362
3-(1-benzylpiperidin-4-yl)-1-(2,3-dihydro-1-benzofuran-5-yl)propan-1-one
CID 19108487
4-[4-[(4-benzylpiperazin-1-yl)methyl]piperidin-1-yl]aniline
CID 177362384
5-(1-benzylpiperidin-4-yl)pentanethioamide
CID 139624929
1-(1-acetyl-2,3,4,5-tetrahydro-1-benzazepin-8-yl)-3-(1-benzylpiperidin-4-yl)propan-1-one
CID 19108439

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[3-(1-benzylpiperidin-4-yl)-1-(4-pyrrolidin-1-ylphenyl)propylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[3-(1-benzylpiperidin-4-yl)-1-(4-pyrrolidin-1-ylphenyl)propylidene]hydroxylamine (CID 19390888) is (NZ)-N-[3-(1-benzylpiperidin-4-yl)-1-(4-pyrrolidin-1-ylphenyl)propylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[3-(1-benzylpiperidin-4-yl)-1-(4-pyrrolidin-1-ylphenyl)propylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[3-(1-benzylpiperidin-4-yl)-1-(4-pyrrolidin-1-ylphenyl)propylidene]hydroxylamine is O/N=C(/CCC1CCN(Cc2ccccc2)CC1)c1ccc(N2CCCC2)cc1.
What is the InChIKey of (NZ)-N-[3-(1-benzylpiperidin-4-yl)-1-(4-pyrrolidin-1-ylphenyl)propylidene]hydroxylamine?
The InChIKey is FWFNCAKKCRJCTP-QPLCGJKRSA-N. The full InChI is InChI=1S/C25H33N3O/c29-26-25(23-9-11-24(12-10-23)28-16-4-5-17-28)13-8-21-14-18-27(19-15-21)20-22-6-2-1-3-7-22/h1-3,6-7,9-12,21,29H,4-5,8,13-20H2/b26-25-.
What are the key properties of (NZ)-N-[3-(1-benzylpiperidin-4-yl)-1-(4-pyrrolidin-1-ylphenyl)propylidene]hydroxylamine?
(NZ)-N-[3-(1-benzylpiperidin-4-yl)-1-(4-pyrrolidin-1-ylphenyl)propylidene]hydroxylamine has a molecular weight of 391.56 g/mol, XLogP of 5.16, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[3-(1-benzylpiperidin-4-yl)-1-(4-pyrrolidin-1-ylphenyl)propylidene]hydroxylamine is sourced from PubChem (CID 19390888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).