N-(5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ylidene)hydroxylamine

C14H25N3O — CID 933756

IUPACN-(5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ylidene)hydroxylamine
SMILESCCCC12CN3CN(C1)CC(CCC)(C3)C2=NO
InChIInChI=1S/C14H25N3O/c1-3-5-13-7-16-9-14(6-4-2,12(13)15-18)10-17(8-13)11-16/h18H,3-11H2,1-2H3
InChIKeySODCXBADPBCBCL-UHFFFAOYSA-N
MW251.37 g/mol
LogP1.99
Rot. Bonds4

About N-(5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ylidene)hydroxylamine

N-(5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ylidene)hydroxylamine (PubChem CID 933756) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is N-(5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ylidene)hydroxylamine.

Molecular Properties

Compound NameN-(5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ylidene)hydroxylamine
PubChem CID933756
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC NameN-(5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ylidene)hydroxylamine
SMILESCCCC12CN3CN(C1)CC(CCC)(C3)C2=NO
InChIInChI=1S/C14H25N3O/c1-3-5-13-7-16-9-14(6-4-2,12(13)15-18)10-17(8-13)11-16/h18H,3-11H2,1-2H3
InChIKeySODCXBADPBCBCL-UHFFFAOYSA-N
XLogP1.99
TPSA39.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 51.99
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 N-(5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ylidene)hydroxylamine 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 N-(5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ylidene)hydroxylamine?
The IUPAC name of N-(5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ylidene)hydroxylamine (CID 933756) is N-(5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ylidene)hydroxylamine.
What is the SMILES notation for N-(5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ylidene)hydroxylamine?
The canonical SMILES for N-(5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ylidene)hydroxylamine is CCCC12CN3CN(C1)CC(CCC)(C3)C2=NO.
What is the InChIKey of N-(5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ylidene)hydroxylamine?
The InChIKey is SODCXBADPBCBCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-3-5-13-7-16-9-14(6-4-2,12(13)15-18)10-17(8-13)11-16/h18H,3-11H2,1-2H3.
What are the key properties of N-(5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ylidene)hydroxylamine?
N-(5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ylidene)hydroxylamine has a molecular weight of 251.37 g/mol, XLogP of 1.99, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-ylidene)hydroxylamine is sourced from PubChem (CID 933756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).