N-(1-decyl-3-methylpiperidin-4-ylidene)hydroxylamine

C16H32N2O — CID 104931044

IUPACN-(1-decyl-3-methylpiperidin-4-ylidene)hydroxylamine
SMILESCCCCCCCCCCN1CCC(=NO)C(C)C1
InChIInChI=1S/C16H32N2O/c1-3-4-5-6-7-8-9-10-12-18-13-11-16(17-19)15(2)14-18/h15,19H,3-14H2,1-2H3
InChIKeyZCZIISOSDPCRLR-UHFFFAOYSA-N
MW268.44 g/mol
LogP4.30
Rot. Bonds9

About N-(1-decyl-3-methylpiperidin-4-ylidene)hydroxylamine

N-(1-decyl-3-methylpiperidin-4-ylidene)hydroxylamine (PubChem CID 104931044) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is N-(1-decyl-3-methylpiperidin-4-ylidene)hydroxylamine.

Molecular Properties

Compound NameN-(1-decyl-3-methylpiperidin-4-ylidene)hydroxylamine
PubChem CID104931044
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC NameN-(1-decyl-3-methylpiperidin-4-ylidene)hydroxylamine
SMILESCCCCCCCCCCN1CCC(=NO)C(C)C1
InChIInChI=1S/C16H32N2O/c1-3-4-5-6-7-8-9-10-12-18-13-11-16(17-19)15(2)14-18/h15,19H,3-14H2,1-2H3
InChIKeyZCZIISOSDPCRLR-UHFFFAOYSA-N
XLogP4.30
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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

3-(4-hydroxyimino-3-methylpiperidin-1-yl)propanamide
CID 104931033
N-[3-methyl-1-[2-(trifluoromethylsulfanyl)ethyl]piperidin-4-ylidene]hydroxylamine
CID 104930954
N-(1,3-dimethylpiperidin-4-ylidene)hydroxylamine
CID 3325353
(NZ)-N-[1-[2-(2-ethoxyphenoxy)ethyl]-3-methylpiperidin-4-ylidene]hydroxylamine
CID 114501023
1-(4-hydroxyimino-3-methylpiperidin-1-yl)butan-1-one
CID 104930760
N-[3-methyl-1-[(2-methyltetrazol-5-yl)methyl]piperidin-4-ylidene]hydroxylamine
CID 107043401
1-(3-ethyl-4-hydroxyiminopiperidin-1-yl)octan-1-one
CID 104931312
N-(3-methyl-1-pentan-2-ylpiperidin-4-ylidene)hydroxylamine
CID 107895778
(NE)-N-[3-methyl-1-[(4-methylphenyl)methyl]piperidin-4-ylidene]hydroxylamine
CID 114501005
N-(1-butylpiperidin-4-ylidene)hydroxylamine
CID 18002055
1-(4-hydroxyimino-3-methylpiperidin-1-yl)-2-propoxyethanone
CID 107939252
1-pentadecylpiperidin-4-one
CID 10267366

Frequently Asked Questions

What is the IUPAC name of N-(1-decyl-3-methylpiperidin-4-ylidene)hydroxylamine?
The IUPAC name of N-(1-decyl-3-methylpiperidin-4-ylidene)hydroxylamine (CID 104931044) is N-(1-decyl-3-methylpiperidin-4-ylidene)hydroxylamine.
What is the SMILES notation for N-(1-decyl-3-methylpiperidin-4-ylidene)hydroxylamine?
The canonical SMILES for N-(1-decyl-3-methylpiperidin-4-ylidene)hydroxylamine is CCCCCCCCCCN1CCC(=NO)C(C)C1.
What is the InChIKey of N-(1-decyl-3-methylpiperidin-4-ylidene)hydroxylamine?
The InChIKey is ZCZIISOSDPCRLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-3-4-5-6-7-8-9-10-12-18-13-11-16(17-19)15(2)14-18/h15,19H,3-14H2,1-2H3.
What are the key properties of N-(1-decyl-3-methylpiperidin-4-ylidene)hydroxylamine?
N-(1-decyl-3-methylpiperidin-4-ylidene)hydroxylamine has a molecular weight of 268.44 g/mol, XLogP of 4.30, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-decyl-3-methylpiperidin-4-ylidene)hydroxylamine is sourced from PubChem (CID 104931044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).