1-amino-2-(1-methoxypropan-2-yl)-3-(5,6,7,8-tetrahydronaphthalen-1-yl)guanidine

C15H24N4O — CID 116511756

IUPAC1-amino-2-(1-methoxypropan-2-yl)-3-(5,6,7,8-tetrahydronaphthalen-1-yl)guanidine
SMILESCOCC(C)/N=C(\NN)Nc1cccc2c1CCCC2
InChIInChI=1S/C15H24N4O/c1-11(10-20-2)17-15(19-16)18-14-9-5-7-12-6-3-4-8-13(12)14/h5,7,9,11H,3-4,6,8,10,16H2,1-2H3,(H2,17,18,19)
InChIKeyNORDHQXTDYXNQG-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.83
Rot. Bonds4

About 1-amino-2-(1-methoxypropan-2-yl)-3-(5,6,7,8-tetrahydronaphthalen-1-yl)guanidine

1-amino-2-(1-methoxypropan-2-yl)-3-(5,6,7,8-tetrahydronaphthalen-1-yl)guanidine (PubChem CID 116511756) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-amino-2-(1-methoxypropan-2-yl)-3-(5,6,7,8-tetrahydronaphthalen-1-yl)guanidine.

Molecular Properties

Compound Name1-amino-2-(1-methoxypropan-2-yl)-3-(5,6,7,8-tetrahydronaphthalen-1-yl)guanidine
PubChem CID116511756
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name1-amino-2-(1-methoxypropan-2-yl)-3-(5,6,7,8-tetrahydronaphthalen-1-yl)guanidine
SMILESCOCC(C)/N=C(\NN)Nc1cccc2c1CCCC2
InChIInChI=1S/C15H24N4O/c1-11(10-20-2)17-15(19-16)18-14-9-5-7-12-6-3-4-8-13(12)14/h5,7,9,11H,3-4,6,8,10,16H2,1-2H3,(H2,17,18,19)
InChIKeyNORDHQXTDYXNQG-UHFFFAOYSA-N
XLogP1.83
TPSA71.67 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.83
H-Bond Donors ≤ 53
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 1-amino-2-(1-methoxypropan-2-yl)-3-(5,6,7,8-tetrahydronaphthalen-1-yl)guanidine 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 1-amino-2-(1-methoxypropan-2-yl)-3-(5,6,7,8-tetrahydronaphthalen-1-yl)guanidine?
The IUPAC name of 1-amino-2-(1-methoxypropan-2-yl)-3-(5,6,7,8-tetrahydronaphthalen-1-yl)guanidine (CID 116511756) is 1-amino-2-(1-methoxypropan-2-yl)-3-(5,6,7,8-tetrahydronaphthalen-1-yl)guanidine.
What is the SMILES notation for 1-amino-2-(1-methoxypropan-2-yl)-3-(5,6,7,8-tetrahydronaphthalen-1-yl)guanidine?
The canonical SMILES for 1-amino-2-(1-methoxypropan-2-yl)-3-(5,6,7,8-tetrahydronaphthalen-1-yl)guanidine is COCC(C)/N=C(\NN)Nc1cccc2c1CCCC2.
What is the InChIKey of 1-amino-2-(1-methoxypropan-2-yl)-3-(5,6,7,8-tetrahydronaphthalen-1-yl)guanidine?
The InChIKey is NORDHQXTDYXNQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-11(10-20-2)17-15(19-16)18-14-9-5-7-12-6-3-4-8-13(12)14/h5,7,9,11H,3-4,6,8,10,16H2,1-2H3,(H2,17,18,19).
What are the key properties of 1-amino-2-(1-methoxypropan-2-yl)-3-(5,6,7,8-tetrahydronaphthalen-1-yl)guanidine?
1-amino-2-(1-methoxypropan-2-yl)-3-(5,6,7,8-tetrahydronaphthalen-1-yl)guanidine has a molecular weight of 276.38 g/mol, XLogP of 1.83, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-(1-methoxypropan-2-yl)-3-(5,6,7,8-tetrahydronaphthalen-1-yl)guanidine is sourced from PubChem (CID 116511756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).