N-(2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene)hydroxylamine

C15H26N2O — CID 4572640

IUPACN-(2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene)hydroxylamine
SMILESC=C(C)C1CCC(C)(N2CCCCC2)C(=NO)C1
InChIInChI=1S/C15H26N2O/c1-12(2)13-7-8-15(3,14(11-13)16-18)17-9-5-4-6-10-17/h13,18H,1,4-11H2,2-3H3
InChIKeyWYPAETSPUQJPSF-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.44
Rot. Bonds2

About N-(2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene)hydroxylamine

N-(2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene)hydroxylamine (PubChem CID 4572640) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is N-(2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene)hydroxylamine.

Molecular Properties

Compound NameN-(2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene)hydroxylamine
PubChem CID4572640
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC NameN-(2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene)hydroxylamine
SMILESC=C(C)C1CCC(C)(N2CCCCC2)C(=NO)C1
InChIInChI=1S/C15H26N2O/c1-12(2)13-7-8-15(3,14(11-13)16-18)17-9-5-4-6-10-17/h13,18H,1,4-11H2,2-3H3
InChIKeyWYPAETSPUQJPSF-UHFFFAOYSA-N
XLogP3.44
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene)hydroxylamine?
The IUPAC name of N-(2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene)hydroxylamine (CID 4572640) is N-(2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene)hydroxylamine.
What is the SMILES notation for N-(2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene)hydroxylamine?
The canonical SMILES for N-(2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene)hydroxylamine is C=C(C)C1CCC(C)(N2CCCCC2)C(=NO)C1.
What is the InChIKey of N-(2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene)hydroxylamine?
The InChIKey is WYPAETSPUQJPSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-12(2)13-7-8-15(3,14(11-13)16-18)17-9-5-4-6-10-17/h13,18H,1,4-11H2,2-3H3.
What are the key properties of N-(2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene)hydroxylamine?
N-(2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene)hydroxylamine has a molecular weight of 250.39 g/mol, XLogP of 3.44, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene)hydroxylamine is sourced from PubChem (CID 4572640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).