(NZ)-N-[(2R,5S)-2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene]hydroxylamine

C15H26N2O — CID 7348692

IUPAC(NZ)-N-[(2R,5S)-2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene]hydroxylamine
SMILESC=C(C)[C@H]1CC[C@@](C)(N2CCCCC2)/C(=N\O)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/b16-14-/t13-,15+/m0/s1
InChIKeyWYPAETSPUQJPSF-QVJUESHNSA-N
MW250.39 g/mol
LogP3.44
Rot. Bonds2

About (NZ)-N-[(2R,5S)-2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene]hydroxylamine

(NZ)-N-[(2R,5S)-2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene]hydroxylamine (PubChem CID 7348692) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is (NZ)-N-[(2R,5S)-2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[(2R,5S)-2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene]hydroxylamine
PubChem CID7348692
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Name(NZ)-N-[(2R,5S)-2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene]hydroxylamine
SMILESC=C(C)[C@H]1CC[C@@](C)(N2CCCCC2)/C(=N\O)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/b16-14-/t13-,15+/m0/s1
InChIKeyWYPAETSPUQJPSF-QVJUESHNSA-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 (NZ)-N-[(2R,5S)-2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[(2R,5S)-2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene]hydroxylamine (CID 7348692) is (NZ)-N-[(2R,5S)-2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[(2R,5S)-2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[(2R,5S)-2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene]hydroxylamine is C=C(C)[C@H]1CC[C@@](C)(N2CCCCC2)/C(=N\O)C1.
What is the InChIKey of (NZ)-N-[(2R,5S)-2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene]hydroxylamine?
The InChIKey is WYPAETSPUQJPSF-QVJUESHNSA-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/b16-14-/t13-,15+/m0/s1.
What are the key properties of (NZ)-N-[(2R,5S)-2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene]hydroxylamine?
(NZ)-N-[(2R,5S)-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 (NZ)-N-[(2R,5S)-2-methyl-2-piperidin-1-yl-5-prop-1-en-2-ylcyclohexylidene]hydroxylamine is sourced from PubChem (CID 7348692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).