N-(1-phenyl-1-piperidin-1-ylpropan-2-ylidene)hydroxylamine

C14H20N2O — CID 3428030

IUPACN-(1-phenyl-1-piperidin-1-ylpropan-2-ylidene)hydroxylamine
SMILESCC(=NO)C(c1ccccc1)N1CCCCC1
InChIInChI=1S/C14H20N2O/c1-12(15-17)14(13-8-4-2-5-9-13)16-10-6-3-7-11-16/h2,4-5,8-9,14,17H,3,6-7,10-11H2,1H3
InChIKeyULKSYLATQCXYNM-UHFFFAOYSA-N
MW232.33 g/mol
LogP3.06
Rot. Bonds3

About N-(1-phenyl-1-piperidin-1-ylpropan-2-ylidene)hydroxylamine

N-(1-phenyl-1-piperidin-1-ylpropan-2-ylidene)hydroxylamine (PubChem CID 3428030) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is N-(1-phenyl-1-piperidin-1-ylpropan-2-ylidene)hydroxylamine.

Molecular Properties

Compound NameN-(1-phenyl-1-piperidin-1-ylpropan-2-ylidene)hydroxylamine
PubChem CID3428030
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC NameN-(1-phenyl-1-piperidin-1-ylpropan-2-ylidene)hydroxylamine
SMILESCC(=NO)C(c1ccccc1)N1CCCCC1
InChIInChI=1S/C14H20N2O/c1-12(15-17)14(13-8-4-2-5-9-13)16-10-6-3-7-11-16/h2,4-5,8-9,14,17H,3,6-7,10-11H2,1H3
InChIKeyULKSYLATQCXYNM-UHFFFAOYSA-N
XLogP3.06
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 53.06
H-Bond Donors ≤ 51
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

2-(azepan-1-yl)-2-phenylethanethioamide
CID 84758024
2-(azocan-1-yl)-2-phenylacetamide
CID 42889497
(1R)-3,3-dimethyl-1-phenyl-1-pyrrolidin-1-ylbutan-2-one
CID 59470882
2-phenyl-2-piperidin-1-ylacetamide;hydrochloride
CID 138401908
methyl 2-phenyl-2-piperidin-1-ylacetate
CID 12957460
(2S)-N-methyl-2-phenyl-2-piperidin-1-ylacetamide
CID 67962694
2-phenyl-1-piperidin-1-yl-2-pyrrolidin-1-ylethanone
CID 47010733
propan-2-yl 2-phenyl-2-piperidin-1-ylacetate
CID 85412876
tert-butyl 2-phenyl-2-piperidin-1-ylacetate;hydrochloride
CID 117066829
propyl (2S)-2-phenyl-2-piperidin-1-ylacetate
CID 97355368
(2R)-N-(ethylcarbamoyl)-2-phenyl-2-piperidin-1-ylacetamide
CID 26551632
(1R,2R)-1-phenyl-2-pyrrolidin-1-ylpropan-1-ol
CID 11830572

Frequently Asked Questions

What is the IUPAC name of N-(1-phenyl-1-piperidin-1-ylpropan-2-ylidene)hydroxylamine?
The IUPAC name of N-(1-phenyl-1-piperidin-1-ylpropan-2-ylidene)hydroxylamine (CID 3428030) is N-(1-phenyl-1-piperidin-1-ylpropan-2-ylidene)hydroxylamine.
What is the SMILES notation for N-(1-phenyl-1-piperidin-1-ylpropan-2-ylidene)hydroxylamine?
The canonical SMILES for N-(1-phenyl-1-piperidin-1-ylpropan-2-ylidene)hydroxylamine is CC(=NO)C(c1ccccc1)N1CCCCC1.
What is the InChIKey of N-(1-phenyl-1-piperidin-1-ylpropan-2-ylidene)hydroxylamine?
The InChIKey is ULKSYLATQCXYNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-12(15-17)14(13-8-4-2-5-9-13)16-10-6-3-7-11-16/h2,4-5,8-9,14,17H,3,6-7,10-11H2,1H3.
What are the key properties of N-(1-phenyl-1-piperidin-1-ylpropan-2-ylidene)hydroxylamine?
N-(1-phenyl-1-piperidin-1-ylpropan-2-ylidene)hydroxylamine has a molecular weight of 232.33 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenyl-1-piperidin-1-ylpropan-2-ylidene)hydroxylamine is sourced from PubChem (CID 3428030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).