N-(1-amino-1-hydroxyiminopentan-3-yl)decanamide

C15H31N3O2 — CID 77069122

IUPACN-(1-amino-1-hydroxyiminopentan-3-yl)decanamide
SMILESCCCCCCCCCC(=O)NC(CC)CC(N)=NO
InChIInChI=1S/C15H31N3O2/c1-3-5-6-7-8-9-10-11-15(19)17-13(4-2)12-14(16)18-20/h13,20H,3-12H2,1-2H3,(H2,16,18)(H,17,19)
InChIKeyKUGPMIDFBQAGMY-UHFFFAOYSA-N
MW285.43 g/mol
LogP3.16
Rot. Bonds12

About N-(1-amino-1-hydroxyiminopentan-3-yl)decanamide

N-(1-amino-1-hydroxyiminopentan-3-yl)decanamide (PubChem CID 77069122) has the molecular formula C15H31N3O2 and a molecular weight of 285.43 g/mol. Its IUPAC name is N-(1-amino-1-hydroxyiminopentan-3-yl)decanamide.

Molecular Properties

Compound NameN-(1-amino-1-hydroxyiminopentan-3-yl)decanamide
PubChem CID77069122
Molecular FormulaC15H31N3O2
Molecular Weight285.43 g/mol
Exact Mass285.24
IUPAC NameN-(1-amino-1-hydroxyiminopentan-3-yl)decanamide
SMILESCCCCCCCCCC(=O)NC(CC)CC(N)=NO
InChIInChI=1S/C15H31N3O2/c1-3-5-6-7-8-9-10-11-15(19)17-13(4-2)12-14(16)18-20/h13,20H,3-12H2,1-2H3,(H2,16,18)(H,17,19)
InChIKeyKUGPMIDFBQAGMY-UHFFFAOYSA-N
XLogP3.16
TPSA87.71 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.43
LogP ≤ 53.16
H-Bond Donors ≤ 53
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': 'imine_2', '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

N-(4-amino-4-hydroxyiminobutan-2-yl)dodecanamide
CID 77069082
N-pentan-3-yldocosanamide
CID 123339332
N-(1-amino-1-sulfanylidenepentan-3-yl)hexanamide
CID 62651450
N-(1-amino-1-hydroxyiminopentan-3-yl)-2-ethylhexanamide
CID 76947816
N-[(1Z)-1-amino-1-hydroxyiminopentan-3-yl]-2-methoxyacetamide
CID 55208859
N-[(2S)-1-hydroxybutan-2-yl]hexanamide
CID 104981701
N-(1-amino-1-hydroxyiminopropan-2-yl)decanamide
CID 77069097
N-(1-aminopentan-3-yl)hexanamide
CID 62652516
N-(2-amino-2-hydroxyiminoethyl)nonanamide
CID 77069137
N-(1,3-dihydroxypropan-2-yl)tridecanamide
CID 87498301
N-(5-amino-5-hydroxyiminopentyl)octanamide
CID 77036923
N'-octan-3-ylbutanediamide
CID 82041118

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-1-hydroxyiminopentan-3-yl)decanamide?
The IUPAC name of N-(1-amino-1-hydroxyiminopentan-3-yl)decanamide (CID 77069122) is N-(1-amino-1-hydroxyiminopentan-3-yl)decanamide.
What is the SMILES notation for N-(1-amino-1-hydroxyiminopentan-3-yl)decanamide?
The canonical SMILES for N-(1-amino-1-hydroxyiminopentan-3-yl)decanamide is CCCCCCCCCC(=O)NC(CC)CC(N)=NO.
What is the InChIKey of N-(1-amino-1-hydroxyiminopentan-3-yl)decanamide?
The InChIKey is KUGPMIDFBQAGMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O2/c1-3-5-6-7-8-9-10-11-15(19)17-13(4-2)12-14(16)18-20/h13,20H,3-12H2,1-2H3,(H2,16,18)(H,17,19).
What are the key properties of N-(1-amino-1-hydroxyiminopentan-3-yl)decanamide?
N-(1-amino-1-hydroxyiminopentan-3-yl)decanamide has a molecular weight of 285.43 g/mol, XLogP of 3.16, 12 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-1-hydroxyiminopentan-3-yl)decanamide is sourced from PubChem (CID 77069122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).