(NZ)-N-(3-morpholin-4-yl-1-naphthalen-2-ylpropylidene)hydroxylamine;hydrochloride

C17H21ClN2O2 — CID 45262592

IUPAC(NZ)-N-(3-morpholin-4-yl-1-naphthalen-2-ylpropylidene)hydroxylamine;hydrochloride
SMILESCl.O/N=C(/CCN1CCOCC1)c1ccc2ccccc2c1
InChIInChI=1S/C17H20N2O2.ClH/c20-18-17(7-8-19-9-11-21-12-10-19)16-6-5-14-3-1-2-4-15(14)13-16;/h1-6,13,20H,7-12H2;1H/b18-17-;
InChIKeyIWWHLAQNVWQVEW-YBFBCAGJSA-N
MW320.82 g/mol
LogP3.16
Rot. Bonds4

About (NZ)-N-(3-morpholin-4-yl-1-naphthalen-2-ylpropylidene)hydroxylamine;hydrochloride

(NZ)-N-(3-morpholin-4-yl-1-naphthalen-2-ylpropylidene)hydroxylamine;hydrochloride (PubChem CID 45262592) has the molecular formula C17H21ClN2O2 and a molecular weight of 320.82 g/mol. Its IUPAC name is (NZ)-N-(3-morpholin-4-yl-1-naphthalen-2-ylpropylidene)hydroxylamine;hydrochloride.

Molecular Properties

Compound Name(NZ)-N-(3-morpholin-4-yl-1-naphthalen-2-ylpropylidene)hydroxylamine;hydrochloride
PubChem CID45262592
Molecular FormulaC17H21ClN2O2
Molecular Weight320.82 g/mol
Exact Mass320.13
IUPAC Name(NZ)-N-(3-morpholin-4-yl-1-naphthalen-2-ylpropylidene)hydroxylamine;hydrochloride
SMILESCl.O/N=C(/CCN1CCOCC1)c1ccc2ccccc2c1
InChIInChI=1S/C17H20N2O2.ClH/c20-18-17(7-8-19-9-11-21-12-10-19)16-6-5-14-3-1-2-4-15(14)13-16;/h1-6,13,20H,7-12H2;1H/b18-17-;
InChIKeyIWWHLAQNVWQVEW-YBFBCAGJSA-N
XLogP3.16
TPSA45.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.82
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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'}

Analyze (NZ)-N-(3-morpholin-4-yl-1-naphthalen-2-ylpropylidene)hydroxylamine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-(3-morpholin-4-yl-1-naphthalen-2-ylpropylidene)hydroxylamine;hydrochloride?
The IUPAC name of (NZ)-N-(3-morpholin-4-yl-1-naphthalen-2-ylpropylidene)hydroxylamine;hydrochloride (CID 45262592) is (NZ)-N-(3-morpholin-4-yl-1-naphthalen-2-ylpropylidene)hydroxylamine;hydrochloride.
What is the SMILES notation for (NZ)-N-(3-morpholin-4-yl-1-naphthalen-2-ylpropylidene)hydroxylamine;hydrochloride?
The canonical SMILES for (NZ)-N-(3-morpholin-4-yl-1-naphthalen-2-ylpropylidene)hydroxylamine;hydrochloride is Cl.O/N=C(/CCN1CCOCC1)c1ccc2ccccc2c1.
What is the InChIKey of (NZ)-N-(3-morpholin-4-yl-1-naphthalen-2-ylpropylidene)hydroxylamine;hydrochloride?
The InChIKey is IWWHLAQNVWQVEW-YBFBCAGJSA-N. The full InChI is InChI=1S/C17H20N2O2.ClH/c20-18-17(7-8-19-9-11-21-12-10-19)16-6-5-14-3-1-2-4-15(14)13-16;/h1-6,13,20H,7-12H2;1H/b18-17-;.
What are the key properties of (NZ)-N-(3-morpholin-4-yl-1-naphthalen-2-ylpropylidene)hydroxylamine;hydrochloride?
(NZ)-N-(3-morpholin-4-yl-1-naphthalen-2-ylpropylidene)hydroxylamine;hydrochloride has a molecular weight of 320.82 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-(3-morpholin-4-yl-1-naphthalen-2-ylpropylidene)hydroxylamine;hydrochloride is sourced from PubChem (CID 45262592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).