Somantadine

C14H25N — CID 50234

IUPAC1-(1-adamantyl)-2-methylpropan-2-amine
SMILESCC(C)(CC12CC3CC(C1)CC(C3)C2)N
InChIInChI=1S/C14H25N/c1-13(2,15)9-14-6-10-3-11(7-14)5-12(4-10)8-14/h10-12H,3-9,15H2,1-2H3
InChIKeyOWKXRDQRMTVCEX-UHFFFAOYSA-N
MW207.35 g/mol
LogP3.70
Rot. Bonds2

About Somantadine

Somantadine (PubChem CID 50234) has the molecular formula C14H25N and a molecular weight of 207.35 g/mol. Its IUPAC name is 1-(1-adamantyl)-2-methylpropan-2-amine.

Molecular Properties

Compound NameSomantadine
PubChem CID50234
Molecular FormulaC14H25N
Molecular Weight207.35 g/mol
Exact Mass207.20
IUPAC Name1-(1-adamantyl)-2-methylpropan-2-amine
SMILESCC(C)(CC12CC3CC(C1)CC(C3)C2)N
InChIInChI=1S/C14H25N/c1-13(2,15)9-14-6-10-3-11(7-14)5-12(4-10)8-14/h10-12H,3-9,15H2,1-2H3
InChIKeyOWKXRDQRMTVCEX-UHFFFAOYSA-N
XLogP3.70
TPSA26.00 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity225

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.35
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze Somantadine with MolForge

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

Launch Full Analysis

Related Compounds

Memantine
CID 4054
Rimantadine
CID 5071
Amantadine
CID 2130
Amantadine Hydrochloride
CID 64150
Memantine Hydrochloride
CID 181458
Rimantadine Hydrochloride
CID 15165
(3R,5S)-3,5-dimethyl-1-adamantanamine
CID 1263681
(1R)-1-(adamantan-1-yl)ethan-1-amine
CID 7048786
(alphaS)-alpha-Methyltricyclo[3.3.1.13,7]decane-1-methanamine
CID 7048784
(1r,3R,5S,7r)-3,5-dimethyladamantan-1-amine hydrochloride
CID 11229655
2-(1-Adamantyl)propan-2-amine
CID 3010140
Adapromine
CID 547499

Frequently Asked Questions

What is the IUPAC name of Somantadine?
The IUPAC name of Somantadine (CID 50234) is 1-(1-adamantyl)-2-methylpropan-2-amine.
What is the SMILES notation for Somantadine?
The canonical SMILES for Somantadine is CC(C)(CC12CC3CC(C1)CC(C3)C2)N.
What is the InChIKey of Somantadine?
The InChIKey is OWKXRDQRMTVCEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N/c1-13(2,15)9-14-6-10-3-11(7-14)5-12(4-10)8-14/h10-12H,3-9,15H2,1-2H3.
What are the key properties of Somantadine?
Somantadine has a molecular weight of 207.35 g/mol, XLogP of 3.70, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for Somantadine is sourced from PubChem (CID 50234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).