(2Z)-N-(5-aminopentyl)-2-hydroxyiminoacetamide

C7H15N3O2 — CID 20836596

IUPAC(2Z)-N-(5-aminopentyl)-2-hydroxyiminoacetamide
SMILESNCCCCCNC(=O)/C=N\O
InChIInChI=1S/C7H15N3O2/c8-4-2-1-3-5-9-7(11)6-10-12/h6,12H,1-5,8H2,(H,9,11)/b10-6-
InChIKeyCCBMZMPVSNGRSI-POHAHGRESA-N
MW173.22 g/mol
LogP-0.31
Rot. Bonds6

About (2Z)-N-(5-aminopentyl)-2-hydroxyiminoacetamide

(2Z)-N-(5-aminopentyl)-2-hydroxyiminoacetamide (PubChem CID 20836596) has the molecular formula C7H15N3O2 and a molecular weight of 173.22 g/mol. Its IUPAC name is (2Z)-N-(5-aminopentyl)-2-hydroxyiminoacetamide.

Molecular Properties

Compound Name(2Z)-N-(5-aminopentyl)-2-hydroxyiminoacetamide
PubChem CID20836596
Molecular FormulaC7H15N3O2
Molecular Weight173.22 g/mol
Exact Mass173.12
IUPAC Name(2Z)-N-(5-aminopentyl)-2-hydroxyiminoacetamide
SMILESNCCCCCNC(=O)/C=N\O
InChIInChI=1S/C7H15N3O2/c8-4-2-1-3-5-9-7(11)6-10-12/h6,12H,1-5,8H2,(H,9,11)/b10-6-
InChIKeyCCBMZMPVSNGRSI-POHAHGRESA-N
XLogP-0.31
TPSA87.71 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 5-0.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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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Frequently Asked Questions

What is the IUPAC name of (2Z)-N-(5-aminopentyl)-2-hydroxyiminoacetamide?
The IUPAC name of (2Z)-N-(5-aminopentyl)-2-hydroxyiminoacetamide (CID 20836596) is (2Z)-N-(5-aminopentyl)-2-hydroxyiminoacetamide.
What is the SMILES notation for (2Z)-N-(5-aminopentyl)-2-hydroxyiminoacetamide?
The canonical SMILES for (2Z)-N-(5-aminopentyl)-2-hydroxyiminoacetamide is NCCCCCNC(=O)/C=N\O.
What is the InChIKey of (2Z)-N-(5-aminopentyl)-2-hydroxyiminoacetamide?
The InChIKey is CCBMZMPVSNGRSI-POHAHGRESA-N. The full InChI is InChI=1S/C7H15N3O2/c8-4-2-1-3-5-9-7(11)6-10-12/h6,12H,1-5,8H2,(H,9,11)/b10-6-.
What are the key properties of (2Z)-N-(5-aminopentyl)-2-hydroxyiminoacetamide?
(2Z)-N-(5-aminopentyl)-2-hydroxyiminoacetamide has a molecular weight of 173.22 g/mol, XLogP of -0.31, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-N-(5-aminopentyl)-2-hydroxyiminoacetamide is sourced from PubChem (CID 20836596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).