N-amino-N',1-dimethyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridine-6-carboximidamide

C11H23N5 — CID 104882364

IUPACN-amino-N',1-dimethyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridine-6-carboximidamide
SMILESC/N=C(\NN)N1CCC2C(CCCN2C)C1
InChIInChI=1S/C11H23N5/c1-13-11(14-12)16-7-5-10-9(8-16)4-3-6-15(10)2/h9-10H,3-8,12H2,1-2H3,(H,13,14)
InChIKeyJACCGJJFFWBWQI-UHFFFAOYSA-N
MW225.34 g/mol
LogP-0.15
Rot. Bonds

About N-amino-N',1-dimethyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridine-6-carboximidamide

N-amino-N',1-dimethyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridine-6-carboximidamide (PubChem CID 104882364) has the molecular formula C11H23N5 and a molecular weight of 225.34 g/mol. Its IUPAC name is N-amino-N',1-dimethyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridine-6-carboximidamide.

Molecular Properties

Compound NameN-amino-N',1-dimethyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridine-6-carboximidamide
PubChem CID104882364
Molecular FormulaC11H23N5
Molecular Weight225.34 g/mol
Exact Mass225.20
IUPAC NameN-amino-N',1-dimethyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridine-6-carboximidamide
SMILESC/N=C(\NN)N1CCC2C(CCCN2C)C1
InChIInChI=1S/C11H23N5/c1-13-11(14-12)16-7-5-10-9(8-16)4-3-6-15(10)2/h9-10H,3-8,12H2,1-2H3,(H,13,14)
InChIKeyJACCGJJFFWBWQI-UHFFFAOYSA-N
XLogP-0.15
TPSA56.89 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-amino-N',1-dimethyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridine-6-carboximidamide 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-amino-N',1-dimethyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridine-6-carboximidamide?
The IUPAC name of N-amino-N',1-dimethyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridine-6-carboximidamide (CID 104882364) is N-amino-N',1-dimethyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridine-6-carboximidamide.
What is the SMILES notation for N-amino-N',1-dimethyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridine-6-carboximidamide?
The canonical SMILES for N-amino-N',1-dimethyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridine-6-carboximidamide is C/N=C(\NN)N1CCC2C(CCCN2C)C1.
What is the InChIKey of N-amino-N',1-dimethyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridine-6-carboximidamide?
The InChIKey is JACCGJJFFWBWQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N5/c1-13-11(14-12)16-7-5-10-9(8-16)4-3-6-15(10)2/h9-10H,3-8,12H2,1-2H3,(H,13,14).
What are the key properties of N-amino-N',1-dimethyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridine-6-carboximidamide?
N-amino-N',1-dimethyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridine-6-carboximidamide has a molecular weight of 225.34 g/mol, XLogP of -0.15, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N',1-dimethyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridine-6-carboximidamide is sourced from PubChem (CID 104882364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).