N-[3-methyl-2,6-bis(4-methylphenyl)piperidin-4-ylidene]hydroxylamine

C20H24N2O — CID 4711818

IUPACN-[3-methyl-2,6-bis(4-methylphenyl)piperidin-4-ylidene]hydroxylamine
SMILESCc1ccc(C2CC(=NO)C(C)C(c3ccc(C)cc3)N2)cc1
InChIInChI=1S/C20H24N2O/c1-13-4-8-16(9-5-13)19-12-18(22-23)15(3)20(21-19)17-10-6-14(2)7-11-17/h4-11,15,19-21,23H,12H2,1-3H3
InChIKeyFZNYSOYEZYRJJH-UHFFFAOYSA-N
MW308.43 g/mol
LogP4.55
Rot. Bonds2

About N-[3-methyl-2,6-bis(4-methylphenyl)piperidin-4-ylidene]hydroxylamine

N-[3-methyl-2,6-bis(4-methylphenyl)piperidin-4-ylidene]hydroxylamine (PubChem CID 4711818) has the molecular formula C20H24N2O and a molecular weight of 308.43 g/mol. Its IUPAC name is N-[3-methyl-2,6-bis(4-methylphenyl)piperidin-4-ylidene]hydroxylamine.

Molecular Properties

Compound NameN-[3-methyl-2,6-bis(4-methylphenyl)piperidin-4-ylidene]hydroxylamine
PubChem CID4711818
Molecular FormulaC20H24N2O
Molecular Weight308.43 g/mol
Exact Mass308.19
IUPAC NameN-[3-methyl-2,6-bis(4-methylphenyl)piperidin-4-ylidene]hydroxylamine
SMILESCc1ccc(C2CC(=NO)C(C)C(c3ccc(C)cc3)N2)cc1
InChIInChI=1S/C20H24N2O/c1-13-4-8-16(9-5-13)19-12-18(22-23)15(3)20(21-19)17-10-6-14(2)7-11-17/h4-11,15,19-21,23H,12H2,1-3H3
InChIKeyFZNYSOYEZYRJJH-UHFFFAOYSA-N
XLogP4.55
TPSA44.62 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 54.55
H-Bond Donors ≤ 52
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

1,3-Dimethyl-2,6-diphenyl-piperidin-4-one oxime
CID 5333825
3,5-diethyl-N-hydroxy-2,6-diphenylpiperidin-4-imine
CID 2729796
3,5-Dimethyl-2,6-diphenyl-piperidin-4-one oxime
CID 2854422
3-Methyl-2,6-diphenyl-4-piperidinone oxime
CID 5333927
Diethyl-[4-(phenyl-piperazin-1-yl-methyl)-benzyl]-amine
CID 10735696
N-[(4-methylphenyl)methyl]-2-(4-methylpiperazin-1-yl)-1-phenylethanamine
CID 72024126
(NE)-N-(2,6-diphenyl-3-propylpiperidin-4-ylidene)hydroxylamine
CID 5333964
(NE)-N-(2,6-diphenyl-3-propan-2-ylpiperidin-4-ylidene)hydroxylamine
CID 5339658
2,3-Diphenylpiperazine
CID 225778
N-(1-benzhydrylpiperidin-4-yl)-N',N'-diethylpropane-1,3-diamine
CID 44389021
N-(1-methyl-2,6-diphenylpiperidin-4-ylidene)hydroxylamine
CID 280709
1-Methyl-3-pentyl-2,6-diphenyl-4-piperidinone oxime
CID 5335923

Frequently Asked Questions

What is the IUPAC name of N-[3-methyl-2,6-bis(4-methylphenyl)piperidin-4-ylidene]hydroxylamine?
The IUPAC name of N-[3-methyl-2,6-bis(4-methylphenyl)piperidin-4-ylidene]hydroxylamine (CID 4711818) is N-[3-methyl-2,6-bis(4-methylphenyl)piperidin-4-ylidene]hydroxylamine.
What is the SMILES notation for N-[3-methyl-2,6-bis(4-methylphenyl)piperidin-4-ylidene]hydroxylamine?
The canonical SMILES for N-[3-methyl-2,6-bis(4-methylphenyl)piperidin-4-ylidene]hydroxylamine is Cc1ccc(C2CC(=NO)C(C)C(c3ccc(C)cc3)N2)cc1.
What is the InChIKey of N-[3-methyl-2,6-bis(4-methylphenyl)piperidin-4-ylidene]hydroxylamine?
The InChIKey is FZNYSOYEZYRJJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O/c1-13-4-8-16(9-5-13)19-12-18(22-23)15(3)20(21-19)17-10-6-14(2)7-11-17/h4-11,15,19-21,23H,12H2,1-3H3.
What are the key properties of N-[3-methyl-2,6-bis(4-methylphenyl)piperidin-4-ylidene]hydroxylamine?
N-[3-methyl-2,6-bis(4-methylphenyl)piperidin-4-ylidene]hydroxylamine has a molecular weight of 308.43 g/mol, XLogP of 4.55, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-methyl-2,6-bis(4-methylphenyl)piperidin-4-ylidene]hydroxylamine is sourced from PubChem (CID 4711818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).